1-[1-[(3,4-diethoxyphenyl)methyl]piperidin-4-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 1-[1-[(3,4-diethoxyphenyl)methyl]piperidin-4-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylic acid Openeye Name: 1-[1-[(3,4-diethoxyphenyl)methyl]-4-piperidyl]-2-oxo-3H-benzimidazole-5-carboxylic acid CAS Name: 1-[1-[(3,4-diethoxyphenyl)methyl]-4-piperidinyl]-2-oxo-3H-benzimidazole-5-carboxylic acid IUPAC Name: 1-[1-[(3,4-diethoxyphenyl)methyl]piperidin-4-yl]-2-oxo-3H-benzimidazole-5-carboxylic acid Traditional Name: 1-[1-(3,4-diethoxybenzyl)-4-piperidyl]-2-keto-3H-benzimidazole-5-carboxylic acid Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O5/c1-3-31-21-8-5-16(13-22(21)32-4-2)15-26-11-9-18(10-12-26)27-20-7-6-17(23(28)29)14-19(20)25-24(27)30/h5-8,13-14,18H,3-4,9-12,15H2,1-2H3,(H,25,30)(H,28,29)