5-[(3-methylphenyl)amino]-2-[(4-methylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-methylphenyl)amino]-2-[(4-methylphenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(3-methylanilino)-5-oxo-2-(p-tolylsulfonylamino)pentanoic acid CAS Name: 5-(3-methylanilino)-2-[(4-methylphenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: 5-(3-methylanilino)-2-[(4-methylphenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-(m-toluidino)-2-(tosylamino)valeric acid Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)NC2=CC=CC(=C2)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)NC2=CC=CC(=C2)C)C(=O)O

InChI

InChI=1S/C19H22N2O5S/c1-13-6-8-16(9-7-13)27(25,26)21-17(19(23)24)10-11-18(22)20-15-5-3-4-14(2)12-15/h3-9,12,17,21H,10-11H2,1-2H3,(H,20,22)(H,23,24)