1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylic acid Openeye Name: 1-[1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-piperidyl]-2-oxo-3H-benzimidazole-5-carboxylic acid CAS Name: 1-[1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-piperidinyl]-2-oxo-3H-benzimidazole-5-carboxylic acid IUPAC Name: 1-[1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-4-yl]-2-oxo-3H-benzimidazole-5-carboxylic acid Traditional Name: 1-[1-(3-ethoxy-4-methoxy-benzyl)-4-piperidyl]-2-keto-3H-benzimidazole-5-carboxylic acid Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCC(CC2)N3C4=C(C=C(C=C4)C(=O)O)NC3=O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCC(CC2)N3C4=C(C=C(C=C4)C(=O)O)NC3=O)OC

InChI

InChI=1S/C23H27N3O5/c1-3-31-21-12-15(4-7-20(21)30-2)14-25-10-8-17(9-11-25)26-19-6-5-16(22(27)28)13-18(19)24-23(26)29/h4-7,12-13,17H,3,8-11,14H2,1-2H3,(H,24,29)(H,27,28)