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

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[2-[(4-sulfamoylphenyl)carbonylamino]ethanoylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[1-oxo-2-[[oxo-(4-sulfamoylphenyl)methyl]amino]ethyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[[2-[(4-sulfamoylbenzoyl)amino]acetyl]amino]butyric acid Formula: C13H16N4O7S MolecularWeight: 372.35374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)NC(CC(=O)N)C(=O)O)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)NC(CC(=O)N)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C13H16N4O7S/c14-10(18)5-9(13(21)22)17-11(19)6-16-12(20)7-1-3-8(4-2-7)25(15,23)24/h1-4,9H,5-6H2,(H2,14,18)(H,16,20)(H,17,19)(H,21,22)(H2,15,23,24)