4-azanyl-4-oxidanylidene-2-[(4-propylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(4-propylphenyl)sulfonylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[(4-propylphenyl)sulfonylamino]butanoic acid CAS Name: 4-amino-4-oxo-2-[(4-propylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(4-propylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-amino-4-keto-2-[(4-propylphenyl)sulfonylamino]butyric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-2-3-9-4-6-10(7-5-9)21(19,20)15-11(13(17)18)8-12(14)16/h4-7,11,15H,2-3,8H2,1H3,(H2,14,16)(H,17,18)