ethyl 4-[4-(2-methylphenyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(2-methylphenyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(o-tolyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-(2-methylphenyl)-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-methylphenyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(o-tolyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C20H24N2O4S/c1-3-26-20(23)17-8-10-18(11-9-17)27(24,25)22-14-12-21(13-15-22)19-7-5-4-6-16(19)2/h4-11H,3,12-15H2,1-2H3