[1-oxidanylidene-1-(propylamino)propan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C19H30N2O5S/c1-6-11-20-18(22)15(5)26-19(23)17(12-13(2)3)21-27(24,25)16-9-7-14(4)8-10-16/h7-10,13,15,17,21H,6,11-12H2,1-5H3,(H,20,22)