[2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]ethyl] 4-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]ethyl] 4-nitrobenzoate Openeye Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-oxo-2-[3-(2-oxo-1-pyrrolidinyl)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-2-[3-(2-ketopyrrolidino)propylamino]ethyl] ester Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O6/c20-14(17-8-2-10-18-9-1-3-15(18)21)11-25-16(22)12-4-6-13(7-5-12)19(23)24/h4-7H,1-3,8-11H2,(H,17,20)