(5R,6S)-5-nitro-6-(3-phenylmethoxyphenyl)piperidin-2-one

Systemtic Name: (5R,6S)-5-nitro-6-(3-phenylmethoxyphenyl)piperidin-2-one Openeye Name: (5R,6S)-6-(3-benzyloxyphenyl)-5-nitro-piperidin-2-one CAS Name: (5R,6S)-5-nitro-6-(3-phenylmethoxyphenyl)-2-piperidinone IUPAC Name: (5R,6S)-5-nitro-6-(3-phenylmethoxyphenyl)piperidin-2-one Traditional Name: (5R,6S)-6-(3-benzoxyphenyl)-5-nitro-2-piperidone Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(C1[N+](=O)[O-])C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N[C@H]([C@@H]1[N+](=O)[O-])C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O4/c21-17-10-9-16(20(22)23)18(19-17)14-7-4-8-15(11-14)24-12-13-5-2-1-3-6-13/h1-8,11,16,18H,9-10,12H2,(H,19,21)/t16-,18+/m1/s1