(phenylmethyl) 4-[[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-1-piperidyl]methyl]piperidine-1-carboxylate CAS Name: 4-[[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-piperidinyl]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]piperidino]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C27H35ClN4O4 MolecularWeight: 515.0442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)OCC4=CC=CC=C4)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)OCC4=CC=CC=C4)Cl)N

InChI

InChI=1S/C27H35ClN4O4/c1-35-25-16-24(29)23(28)15-22(25)26(33)30-21-9-11-31(12-10-21)17-19-7-13-32(14-8-19)27(34)36-18-20-5-3-2-4-6-20/h2-6,15-16,19,21H,7-14,17-18,29H2,1H3,(H,30,33)