(phenylmethyl) (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: benzyl (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: (2S,3S)-6-methyl-3-nitro-2-phenyl-3,4-dihydro-2H-pyridine-1-carboxylic acid benzyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC[C@@H]([C@@H](N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O4/c1-15-12-13-18(22(24)25)19(17-10-6-3-7-11-17)21(15)20(23)26-14-16-8-4-2-5-9-16/h2-12,18-19H,13-14H2,1H3/t18-,19-/m0/s1