[5-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-2-oxidanyl-phenyl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [5-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-2-oxidanyl-phenyl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[2-hydroxy-5-[(3-hydroxy-4-methoxy-phenyl)methylamino]phenyl]methanone CAS Name: [2-hydroxy-5-[(3-hydroxy-4-methoxyphenyl)methylamino]phenyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[2-hydroxy-5-[(3-hydroxy-4-methoxyphenyl)methylamino]phenyl]methanone Traditional Name: (4-benzylpiperidino)-[2-hydroxy-5-[(3-hydroxy-4-methoxy-benzyl)amino]phenyl]methanone Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=CC(=C(C=C2)O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=CC(=C(C=C2)O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C27H30N2O4/c1-33-26-10-7-21(16-25(26)31)18-28-22-8-9-24(30)23(17-22)27(32)29-13-11-20(12-14-29)15-19-5-3-2-4-6-19/h2-10,16-17,20,28,30-31H,11-15,18H2,1H3