(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 3-methyl-4-nitro-benzoate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 3-methyl-4-nitro-benzoate Openeye Name: (2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (2-keto-1-phenyl-2-pyrrolidino-ethyl) ester Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c1-14-13-16(9-10-17(14)22(25)26)20(24)27-18(15-7-3-2-4-8-15)19(23)21-11-5-6-12-21/h2-4,7-10,13,18H,5-6,11-12H2,1H3