[4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl] ethanoate

Systemtic Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl] ethanoate Openeye Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl] acetate CAS Name: acetic acid [4-[[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl] ester IUPAC Name: [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl] acetate Traditional Name: acetic acid [4-[4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC(=O)C)C

InChI

InChI=1S/C21H24N2O5S/c1-15-4-9-20(14-16(15)2)29(26,27)23-12-10-22(11-13-23)21(25)18-5-7-19(8-6-18)28-17(3)24/h4-9,14H,10-13H2,1-3H3