methyl 3-nitro-5-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[(2-oxo-2-pyrrolidin-1-yl-ethyl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[[2-oxo-2-(1-pyrrolidinyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]benzoate Traditional Name: 3-[(2-keto-2-pyrrolidino-ethyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCC(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCC(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6/c1-24-15(21)11-6-10(7-12(8-11)18(22)23)14(20)16-9-13(19)17-4-2-3-5-17/h6-8H,2-5,9H2,1H3,(H,16,20)