methyl 2-[(3-azanyl-5-chloranyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(3-azanyl-5-chloranyl-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(3-amino-5-chloro-4-methyl-phenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[(3-amino-5-chloro-4-methyl-phenyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C13H19ClN2O4S MolecularWeight: 334.81896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1N)S(=O)(=O)NC(C(C)C)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1N)S(=O)(=O)NC(C(C)C)C(=O)OC)Cl

InChI

InChI=1S/C13H19ClN2O4S/c1-7(2)12(13(17)20-4)16-21(18,19)9-5-10(14)8(3)11(15)6-9/h5-7,12,16H,15H2,1-4H3