methyl 4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]benzoate CAS Name: 4-[oxo-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]benzoate Traditional Name: 4-[4-[(E)-styryl]sulfonylpiperazine-1-carbonyl]benzoic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-28-21(25)19-9-7-18(8-10-19)20(24)22-12-14-23(15-13-22)29(26,27)16-11-17-5-3-2-4-6-17/h2-11,16H,12-15H2,1H3/b16-11+