5-azanyl-2-[(4-ethylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(4-ethylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4-ethylphenyl)sulfonylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(4-ethylphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(4-ethylphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(4-ethylphenyl)sulfonylamino]-5-keto-valeric acid Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C13H18N2O5S/c1-2-9-3-5-10(6-4-9)21(19,20)15-11(13(17)18)7-8-12(14)16/h3-6,11,15H,2,7-8H2,1H3,(H2,14,16)(H,17,18)