(3S)-3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]hexanoic acid

Systemtic Name: (3S)-3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]hexanoic acid Openeye Name: (3S)-3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxo-benzimidazol-1-yl]hexanoic acid CAS Name: (3S)-3-[3-[(1,4-dimethyl-3-indolyl)methyl]-2-oxo-1-benzimidazolyl]hexanoic acid IUPAC Name: (3S)-3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxobenzimidazol-1-yl]hexanoic acid Traditional Name: (3S)-3-[3-[(1,4-dimethylindol-3-yl)methyl]-2-keto-benzimidazol-1-yl]hexanoic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C

Isomeric SMILES

CCC[C@@H](CC(=O)O)N1C2=CC=CC=C2N(C1=O)CC3=CN(C4=CC=CC(=C43)C)C

InChI

InChI=1S/C24H27N3O3/c1-4-8-18(13-22(28)29)27-20-11-6-5-10-19(20)26(24(27)30)15-17-14-25(3)21-12-7-9-16(2)23(17)21/h5-7,9-12,14,18H,4,8,13,15H2,1-3H3,(H,28,29)/t18-/m0/s1