[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl] 3H-benzimidazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-4-yl]amino]ethyl] 3H-benzimidazole-5-carboxylate Openeye Name: [2-[(1-benzyl-4-piperidyl)amino]-2-oxo-ethyl] 3H-benzimidazole-5-carboxylate CAS Name: 3H-benzimidazole-5-carboxylic acid [2-oxo-2-[[1-(phenylmethyl)-4-piperidinyl]amino]ethyl] ester IUPAC Name: [2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl] 3H-benzimidazole-5-carboxylate Traditional Name: 3H-benzimidazole-5-carboxylic acid [2-[(1-benzyl-4-piperidyl)amino]-2-keto-ethyl] ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)COC(=O)C2=CC3=C(C=C2)N=CN3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)COC(=O)C2=CC3=C(C=C2)N=CN3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3/c27-21(14-29-22(28)17-6-7-19-20(12-17)24-15-23-19)25-18-8-10-26(11-9-18)13-16-4-2-1-3-5-16/h1-7,12,15,18H,8-11,13-14H2,(H,23,24)(H,25,27)