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

Systemtic Name: (4-aminocarbonylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: (4-carbamoylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butyric acid (4-carbamoylbenzyl) ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)C(=O)N)NS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=C(C=C1)C(=O)N)NS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H21ClN2O5S/c1-12(2)17(22-28(25,26)16-5-3-4-15(20)10-16)19(24)27-11-13-6-8-14(9-7-13)18(21)23/h3-10,12,17,22H,11H2,1-2H3,(H2,21,23)/t17-/m0/s1