[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-nitrobenzoate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5/c20-16-5-2-10-18(16)13-6-8-15(9-7-13)24-17(21)12-3-1-4-14(11-12)19(22)23/h1,3-4,6-9,11H,2,5,10H2