Chem
J-GLOBAL ID:201707010698928776
Nikkaji number:J3.583.471K
CAM-4066
3-(3-{3-[({2-クロロ-[1,1'-ビフェニル]-4-イル}メチル)アミノ]プロパンアミド}プロパンアミド)安息香酸
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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:
C26 H26 ClN3 O4
Molecular formula furigana:
C26-H26-CL-N3-O4
Molecular weight:
479.960
InChI:
InChI=1S/C26H26ClN3O4/c27-23-15-18(9-10-22(23)19-5-2-1-3-6-19)17-28-13-11-24(31)29-14-12-25(32)30-21-8-4-7-20(16-21)26(33)34/h1-10,15-16,28H,11-14,17H2,(H,29,31)(H,30,32)(H,33,34)
InChI key:
NZDQDPKZQDWCOF-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(NC(=O)CCNC(=O)CCNCc2ccc(c(Cl)c2)c2ccccc2)c1
Systematic name (3):
3-[[3-[[3-[[(2-クロロビフェニル-4-イル)メチル]アミノ]プロパノイル]アミノ]プロパノイル]アミノ]安息香酸
3-(3-{3-[({2-クロロ-[1,1'-ビフェニル]-4-イル}メチル)アミノ]プロパンアミド}プロパンアミド)安息香酸
3-(3-{3-[({2-chloro-[1,1'-biphenyl]-4-yl}methyl)amino]propanamido}propanamido)benzoic acid
Other name (2):
3-[[3-[[3-[[(2-Chlorobiphenyl-4-yl)methyl]amino]propanoyl]amino]propanoyl]amino]benzoic acid
CAM-4066
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