[methyl(2-methylpropoxycarbonyl)amino] 4-methylbenzenesulfonate

Systemtic Name: [methyl(2-methylpropoxycarbonyl)amino] 4-methylbenzenesulfonate Openeye Name: [isobutoxycarbonyl(methyl)amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [methyl-[2-methylpropoxy(oxo)methyl]amino] ester IUPAC Name: [methyl(2-methylpropoxycarbonyl)amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [isobutoxycarbonyl(methyl)amino] ester Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON(C)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON(C)C(=O)OCC(C)C

InChI

InChI=1S/C13H19NO5S/c1-10(2)9-18-13(15)14(4)19-20(16,17)12-7-5-11(3)6-8-12/h5-8,10H,9H2,1-4H3