methyl 6-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamoylamino]-2-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: methyl 6-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamoylamino]-2-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: methyl 6-[(5-chloro-2,4-dimethoxy-phenyl)carbamoylamino]-2-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[[(5-chloro-2,4-dimethoxyanilino)-oxomethyl]amino]-2-[(4-methylphenyl)sulfonylamino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(5-chloro-2,4-dimethoxyphenyl)carbamoylamino]-2-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-[(5-chloro-2,4-dimethoxy-phenyl)carbamoylamino]-2-(tosylamino)hexanoic acid methyl ester Formula: C23H30ClN3O7S MolecularWeight: 528.0182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)NC2=CC(=C(C=C2OC)OC)Cl)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)NC2=CC(=C(C=C2OC)OC)Cl)C(=O)OC

InChI

InChI=1S/C23H30ClN3O7S/c1-15-8-10-16(11-9-15)35(30,31)27-18(22(28)34-4)7-5-6-12-25-23(29)26-19-13-17(24)20(32-2)14-21(19)33-3/h8-11,13-14,18,27H,5-7,12H2,1-4H3,(H2,25,26,29)