methyl 3-nitro-5-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[[3-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[3-(2-oxo-1-pyrrolidinyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[[3-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoate Traditional Name: 3-[[3-(2-ketopyrrolidino)phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O6/c1-28-19(25)13-8-12(9-16(10-13)22(26)27)18(24)20-14-4-2-5-15(11-14)21-7-3-6-17(21)23/h2,4-5,8-11H,3,6-7H2,1H3,(H,20,24)