2-azanyl-4-[2-[(4-nitrophenyl)carbonylamino]ethanoylamino]-3-oxidanylidene-butanoic acid

Systemtic Name: 2-azanyl-4-[2-[(4-nitrophenyl)carbonylamino]ethanoylamino]-3-oxidanylidene-butanoic acid Openeye Name: 2-amino-4-[[2-[(4-nitrobenzoyl)amino]acetyl]amino]-3-oxo-butanoic acid CAS Name: 2-amino-4-[[2-[[(4-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]-3-oxobutanoic acid IUPAC Name: 2-amino-4-[[2-[(4-nitrobenzoyl)amino]acetyl]amino]-3-oxobutanoic acid Traditional Name: 2-amino-3-keto-4-[[2-[(4-nitrobenzoyl)amino]acetyl]amino]butyric acid Formula: C13H14N4O7 MolecularWeight: 338.27286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)C(C(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)NCC(=O)C(C(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O7/c14-11(13(21)22)9(18)5-15-10(19)6-16-12(20)7-1-3-8(4-2-7)17(23)24/h1-4,11H,5-6,14H2,(H,15,19)(H,16,20)(H,21,22)