Chem
J-GLOBAL ID:200907006788518097
Nikkaji number:J499.650J
N-[4-[(2-Propynyl)[(2-(trifluoromethyl)-4-chloroquinolin-6-yl)methyl]amino]benzoyl]-L-glutamic acid
N-[4-[(2-プロピニル)[(2-(トリフルオロメチル)-4-クロロキノリン-6-イル)メチル]アミノ]ベンゾイル]-L-グルタミン酸
Download MOL file
Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C26 H21 ClF3 N3 O5
Molecular formula furigana:
C26-H21-CL-F3-N3-O5
Molecular weight:
547.920
InChI:
InChI=1S/C26H21ClF3N3O5/c1-2-11-33(14-15-3-8-20-18(12-15)19(27)13-22(31-20)26(28,29)30)17-6-4-16(5-7-17)24(36)32-21(25(37)38)9-10-23(34)35/h1,3-8,12-13,21H,9-11,14H2,(H,32,36)(H,34,35)(H,37,38)/t21-/m0/s1
InChI key:
WQNJFSFVXQITKT-NRFANRHFSA-N
SMILES:
OC(=O)CC[C@H](NC(=O)c1ccc(cc1)N(CC#C)Cc1ccc2nc(cc(Cl)c2c1)C(F)(F)F)C(=O)O
Systematic name (3):
N-[4-[(2-プロピニル)[(2-(トリフルオロメチル)-4-クロロキノリン-6-イル)メチル]アミノ]ベンゾイル]-L-グルタミン酸
(2S)-2-{[4-({[4-クロロ-2-(トリフルオロメチル)キノリン-6-イル]メチル}(プロパ-2-イン-1-イル)アミノ)フェニル]ホルムアミド}ペンタン二酸
(2S)-2-{[4-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}(prop-2-yn-1-yl)amino)phenyl]formamido}pentanedioic acid
Other name (1):
N-[4-[(2-Propynyl)[(2-(trifluoromethyl)-4-chloroquinolin-6-yl)methyl]amino]benzoyl]-L-glutamic acid
Thsaurus map:
Return to Previous Page