dimethyl 5-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzene-1,3-dicarboxylate CAS Name: 5-[[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]sulfonyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(naphthalene-2-carbonyl)piperazin-1-yl]sulfonylbenzene-1,3-dicarboxylate Traditional Name: 5-[4-(2-naphthoyl)piperazino]sulfonylbenzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)C(=O)OC

InChI

InChI=1S/C25H24N2O7S/c1-33-24(29)20-14-21(25(30)34-2)16-22(15-20)35(31,32)27-11-9-26(10-12-27)23(28)19-8-7-17-5-3-4-6-18(17)13-19/h3-8,13-16H,9-12H2,1-2H3