4-[[6-(2-cyclopentylethanoylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[6-(2-cyclopentylethanoylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-[(2-cyclopentylacetyl)amino]benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[(2-cyclopentyl-1-oxoethyl)amino]-1-benzimidazolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-[(2-cyclopentylacetyl)amino]benzimidazol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-[(2-cyclopentylacetyl)amino]benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)CN2C=NC3=C2C=C(C=C3)NC(=O)CC4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)CN2C=NC3=C2C=C(C=C3)NC(=O)CC4CCCC4

InChI

InChI=1S/C23H25N3O4/c1-30-21-11-16(23(28)29)6-7-17(21)13-26-14-24-19-9-8-18(12-20(19)26)25-22(27)10-15-4-2-3-5-15/h6-9,11-12,14-15H,2-5,10,13H2,1H3,(H,25,27)(H,28,29)