N-[3-(4-nitrophenyl)-3-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]benzamide

Systemtic Name: N-[3-(4-nitrophenyl)-3-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]benzamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)-3-hydroxy-3-(4-nitrophenyl)propyl]benzamide CAS Name: N-[3-hydroxy-3-(4-nitrophenyl)-2-[4-(phenylmethyl)-1-piperidinyl]propyl]benzamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)-3-hydroxy-3-(4-nitrophenyl)propyl]benzamide Traditional Name: N-[2-(4-benzylpiperidino)-3-hydroxy-3-(4-nitrophenyl)propyl]benzamide Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CC=C3)C(C4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CC=C3)C(C4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C28H31N3O4/c32-27(23-11-13-25(14-12-23)31(34)35)26(20-29-28(33)24-9-5-2-6-10-24)30-17-15-22(16-18-30)19-21-7-3-1-4-8-21/h1-14,22,26-27,32H,15-20H2,(H,29,33)