methyl 3-(4-methylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: methyl 3-(4-methylpiperazin-1-yl)sulfonylbenzoate Openeye Name: methyl 3-(4-methylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 3-(4-methylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-methylpiperazino)sulfonylbenzoic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C13H18N2O4S/c1-14-6-8-15(9-7-14)20(17,18)12-5-3-4-11(10-12)13(16)19-2/h3-5,10H,6-9H2,1-2H3