(5S,6R)-5-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-5-nitro-6-phenyl-piperidin-2-one

Systemtic Name: (5S,6R)-5-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-5-nitro-6-phenyl-piperidin-2-one Openeye Name: (5S,6R)-5-[(E)-3-(2-methoxyphenyl)allyl]-5-nitro-6-phenyl-piperidin-2-one CAS Name: (5S,6R)-5-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-5-nitro-6-phenyl-2-piperidinone IUPAC Name: (5S,6R)-5-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-5-nitro-6-phenylpiperidin-2-one Traditional Name: (5S,6R)-5-[(E)-3-(2-methoxyphenyl)allyl]-5-nitro-6-phenyl-2-piperidone Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CCC2(CCC(=O)NC2C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1/C=C/C[C@]2(CCC(=O)N[C@@H]2C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O4/c1-27-18-12-6-5-8-16(18)11-7-14-21(23(25)26)15-13-19(24)22-20(21)17-9-3-2-4-10-17/h2-12,20H,13-15H2,1H3,(H,22,24)/b11-7+/t20-,21-/m1/s1