aminocarbonyl 2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidine-4-carboxylate

Systemtic Name: aminocarbonyl 2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidine-4-carboxylate Openeye Name: carbamoyl 2-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidine-4-carboxylate CAS Name: 2-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]-1-phenyl-4-piperidinecarboxylic acid carbamoyl ester IUPAC Name: carbamoyl 2-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]-1-phenylpiperidine-4-carboxylate Traditional Name: 2-[(3-chloro-4-methoxy-benzyl)carbamoyl]-1-phenyl-isonipecotic acid carbamoyl ester Formula: C22H24ClN3O5 MolecularWeight: 445.89606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CC(CCN2C3=CC=CC=C3)C(=O)OC(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2CC(CCN2C3=CC=CC=C3)C(=O)OC(=O)N)Cl

InChI

InChI=1S/C22H24ClN3O5/c1-30-19-8-7-14(11-17(19)23)13-25-20(27)18-12-15(21(28)31-22(24)29)9-10-26(18)16-5-3-2-4-6-16/h2-8,11,15,18H,9-10,12-13H2,1H3,(H2,24,29)(H,25,27)