methyl 3-[(2-chlorophenyl)sulfonylamino]-5-[(2-methylpropanoylamino)methyl]benzoate

Systemtic Name: methyl 3-[(2-chlorophenyl)sulfonylamino]-5-[(2-methylpropanoylamino)methyl]benzoate Openeye Name: methyl 3-[(2-chlorophenyl)sulfonylamino]-5-[(2-methylpropanoylamino)methyl]benzoate CAS Name: 3-[(2-chlorophenyl)sulfonylamino]-5-[[(2-methyl-1-oxopropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-chlorophenyl)sulfonylamino]-5-[(2-methylpropanoylamino)methyl]benzoate Traditional Name: 3-[(2-chlorophenyl)sulfonylamino]-5-[(isobutyrylamino)methyl]benzoic acid methyl ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC1=CC(=CC(=C1)C(=O)OC)NS(=O)(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C(=O)NCC1=CC(=CC(=C1)C(=O)OC)NS(=O)(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C19H21ClN2O5S/c1-12(2)18(23)21-11-13-8-14(19(24)27-3)10-15(9-13)22-28(25,26)17-7-5-4-6-16(17)20/h4-10,12,22H,11H2,1-3H3,(H,21,23)