methyl 4-[2-[[5-chloranyl-2-methoxy-3-(4-methylphenyl)sulfonyl-phenyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[[5-chloranyl-2-methoxy-3-(4-methylphenyl)sulfonyl-phenyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[5-chloro-2-methoxy-3-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 4-[[2-[5-chloro-2-methoxy-3-(4-methylphenyl)sulfonylanilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[5-chloro-2-methoxy-3-(4-methylphenyl)sulfonylanilino]acetyl]amino]benzoate Traditional Name: 4-[[2-(5-chloro-2-methoxy-3-tosyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C24H23ClN2O6S MolecularWeight: 502.96722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2)Cl)NCC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=CC(=C2)Cl)NCC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C24H23ClN2O6S/c1-15-4-10-19(11-5-15)34(30,31)21-13-17(25)12-20(23(21)32-2)26-14-22(28)27-18-8-6-16(7-9-18)24(29)33-3/h4-13,26H,14H2,1-3H3,(H,27,28)