Chem
J-GLOBAL ID:200907004629344026
Nikkaji number:J2.482.481K
Diisopropylcarbamic acid (1Z,3S,4S)-4-(4-bromophenyl)-4-hydroxy-3-methyl-1-(2-methyl-1-propenyl)-1-butenyl ester
ジイソプロピルカルバミド酸(1Z,3S,4S)-4-(4-ブロモフェニル)-4-ヒドロキシ-3-メチル-1-(2-メチル-1-プロペニル)-1-ブテニル
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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:
C22 H32 BrNO3
Molecular formula furigana:
C22-H32-BR-N-O3
Molecular weight:
438.406
InChI:
InChI=1S/C22H32BrNO3/c1-14(2)12-20(27-22(26)24(15(3)4)16(5)6)13-17(7)21(25)18-8-10-19(23)11-9-18/h8-13,15-17,21,25H,1-7H3/b20-13-/t17-,21-/m0/s1
InChI key:
OXVCEIMZKBCGNP-KUTDZNSHSA-N
SMILES:
CC(C)N(C(C)C)C(=O)O/C(=C\[C@H](C)[C@H](O)c1ccc(Br)cc1)/C=C(C)C
Systematic name (3):
ジイソプロピルカルバミド酸(1Z,3S,4S)-4-(4-ブロモフェニル)-4-ヒドロキシ-3-メチル-1-(2-メチル-1-プロペニル)-1-ブテニル
(4Z,6S,7S)-7-(4-ブロモフェニル)-7-ヒドロキシ-2,6-ジメチルヘプタ-2,4-ジエン-4-イル N,N-ビス(プロパン-2-イル)カルバマート
(4Z,6S,7S)-7-(4-bromophenyl)-7-hydroxy-2,6-dimethylhepta-2,4-dien-4-yl N,N-bis(propan-2-yl)carbamate
Other name (1):
Diisopropylcarbamic acid (1Z,3S,4S)-4-(4-bromophenyl)-4-hydroxy-3-methyl-1-(2-methyl-1-propenyl)-1-butenyl ester
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