3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbonylbenzoate

Systemtic Name: 3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]carbonylbenzoate Openeye Name: 3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]benzoate CAS Name: 3-[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-oxomethyl]benzoate IUPAC Name: 3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]benzoate Traditional Name: 3-[4-(4-methoxyphenyl)sulfonylpiperazine-1-carbonyl]benzoate Formula: C19H19N2O6S- MolecularWeight: 403.42896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-27-16-5-7-17(8-6-16)28(25,26)21-11-9-20(10-12-21)18(22)14-3-2-4-15(13-14)19(23)24/h2-8,13H,9-12H2,1H3,(H,23,24)/p-1