(3S)-1-[(2-methoxy-6-oxidanyl-phenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2-methoxy-6-oxidanyl-phenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[(2-hydroxy-6-methoxy-phenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide CAS Name: (3S)-1-[(2-hydroxy-6-methoxyphenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2-hydroxy-6-methoxyphenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(2-hydroxy-6-methoxy-benzyl)-N-[2-(4-methoxyphenyl)phenyl]nipecotamide Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=CC=C2NC(=O)C3CCCN(C3)CC4=C(C=CC=C4OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=CC=C2NC(=O)[C@H]3CCCN(C3)CC4=C(C=CC=C4OC)O

InChI

InChI=1S/C27H30N2O4/c1-32-21-14-12-19(13-15-21)22-8-3-4-9-24(22)28-27(31)20-7-6-16-29(17-20)18-23-25(30)10-5-11-26(23)33-2/h3-5,8-15,20,30H,6-7,16-18H2,1-2H3,(H,28,31)/t20-/m0/s1