(2-methylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: (2-methylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: o-tolylmethyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butyric acid (2-methylbenzyl) ester Formula: C19H22ClNO4S MolecularWeight: 395.90028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C(C(C)C)NS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CC=CC=C1COC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H22ClNO4S/c1-13(2)18(19(22)25-12-15-8-5-4-7-14(15)3)21-26(23,24)17-10-6-9-16(20)11-17/h4-11,13,18,21H,12H2,1-3H3/t18-/m0/s1