(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C20H20ClN3O5 MolecularWeight: 417.8429

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN3O5/c21-17-6-2-1-5-14(17)12-22-18-8-7-15(24(27)28)11-16(18)20(26)29-13-19(25)23-9-3-4-10-23/h1-2,5-8,11,22H,3-4,9-10,12-13H2