6-[(2-azanyl-2-oxidanylidene-ethyl)carbamoylamino]-2-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-[(2-azanyl-2-oxidanylidene-ethyl)carbamoylamino]-2-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-[(2-amino-2-oxo-ethyl)carbamoylamino]-2-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-[[[(2-amino-2-oxoethyl)amino]-oxomethyl]amino]-2-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-[(2-amino-2-oxoethyl)carbamoylamino]-2-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-[(2-amino-2-keto-ethyl)carbamoylamino]-2-keto-1H-quinoline-3-carboxylic acid Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)NCC(=O)N)C=C(C(=O)N2)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)NCC(=O)N)C=C(C(=O)N2)C(=O)O

InChI

InChI=1S/C13H12N4O5/c14-10(18)5-15-13(22)16-7-1-2-9-6(3-7)4-8(12(20)21)11(19)17-9/h1-4H,5H2,(H2,14,18)(H,17,19)(H,20,21)(H2,15,16,22)