2-[(4-nitrophenyl)carbamoylamino]ethanoic acid; pyrrolidine-1-carboxamide

Systemtic Name: 2-[(4-nitrophenyl)carbamoylamino]ethanoic acid; pyrrolidine-1-carboxamide Openeye Name: 2-[(4-nitrophenyl)carbamoylamino]acetic acid; pyrrolidine-1-carboxamide CAS Name: 2-[[(4-nitroanilino)-oxomethyl]amino]acetic acid; 1-pyrrolidinecarboxamide IUPAC Name: 2-[(4-nitrophenyl)carbamoylamino]acetic acid; pyrrolidine-1-carboxamide Traditional Name: 2-[(4-nitrophenyl)carbamoylamino]acetic acid; pyrrolidine-1-carboxamide Formula: C14H19N5O6 MolecularWeight: 353.33056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N.C1=CC(=CC=C1NC(=O)NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)N.C1=CC(=CC=C1NC(=O)NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O5.C5H10N2O/c13-8(14)5-10-9(15)11-6-1-3-7(4-2-6)12(16)17;6-5(8)7-3-1-2-4-7/h1-4H,5H2,(H,13,14)(H2,10,11,15);1-4H2,(H2,6,8)