1-[1-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]butyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[1-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]butyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[1-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxo-benzimidazol-1-yl]butyl]cyclopropanecarboxylic acid CAS Name: 1-[1-[3-[(1,4-dimethyl-3-indolyl)methyl]-2-oxo-1-benzimidazolyl]butyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[1-[3-[(1,4-dimethylindol-3-yl)methyl]-2-oxobenzimidazol-1-yl]butyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[1-[3-[(1,4-dimethylindol-3-yl)methyl]-2-keto-benzimidazol-1-yl]butyl]cyclopropanecarboxylic acid Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1(CC1)C(=O)O)N2C3=CC=CC=C3N(C2=O)CC4=CN(C5=CC=CC(=C54)C)C

Isomeric SMILES

CCCC(C1(CC1)C(=O)O)N2C3=CC=CC=C3N(C2=O)CC4=CN(C5=CC=CC(=C54)C)C

InChI

InChI=1S/C26H29N3O3/c1-4-8-22(26(13-14-26)24(30)31)29-20-11-6-5-10-19(20)28(25(29)32)16-18-15-27(3)21-12-7-9-17(2)23(18)21/h5-7,9-12,15,22H,4,8,13-14,16H2,1-3H3,(H,30,31)