dimethyl 2-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C24H29N3O7S MolecularWeight: 503.56796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC)C

InChI

InChI=1S/C24H29N3O7S/c1-16-5-7-19(13-17(16)2)35(31,32)27-11-9-26(10-12-27)15-22(28)25-21-14-18(23(29)33-3)6-8-20(21)24(30)34-4/h5-8,13-14H,9-12,15H2,1-4H3,(H,25,28)