methyl 4-[[4-[(2-methoxy-5-methyl-phenyl)carbamoyl-(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(2-methoxy-5-methyl-phenyl)carbamoyl-(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[(2-methoxy-5-methyl-phenyl)carbamoyl-(3-pyridylmethyl)amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[[(2-methoxy-5-methylanilino)-oxomethyl]-(3-pyridinylmethyl)amino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(2-methoxy-5-methylphenyl)carbamoyl-(pyridin-3-ylmethyl)amino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[(2-methoxy-5-methyl-phenyl)carbamoyl-(3-pyridylmethyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CN=CC=C2)C3CCN(CC3)CC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CN=CC=C2)C3CCN(CC3)CC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C29H34N4O4/c1-21-6-11-27(36-2)26(17-21)31-29(35)33(20-23-5-4-14-30-18-23)25-12-15-32(16-13-25)19-22-7-9-24(10-8-22)28(34)37-3/h4-11,14,17-18,25H,12-13,15-16,19-20H2,1-3H3,(H,31,35)