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

Systemtic Name: (4-cyanophenyl) 3-(4-methylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (4-cyanophenyl) 3-(4-methylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-(4-methylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-methylpiperazino)sulfonylbenzoic acid (4-cyanophenyl) ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H19N3O4S/c1-21-9-11-22(12-10-21)27(24,25)18-4-2-3-16(13-18)19(23)26-17-7-5-15(14-20)6-8-17/h2-8,13H,9-12H2,1H3