N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-[(4-benzyloxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-[(4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-(4-benzoxybenzyl)isonipecotamide Formula: C27H30ClN3O3 MolecularWeight: 479.9984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H30ClN3O3/c1-33-26-16-24(29)23(28)15-25(26)30-27(32)21-11-13-31(14-12-21)17-19-7-9-22(10-8-19)34-18-20-5-3-2-4-6-20/h2-10,15-16,21H,11-14,17-18,29H2,1H3,(H,30,32)