methyl 4-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 4-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: methyl 4-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-(3-methoxyphenyl)-1-piperazinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]sulfonylbenzoic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H22N2O5S/c1-25-17-5-3-4-16(14-17)20-10-12-21(13-11-20)27(23,24)18-8-6-15(7-9-18)19(22)26-2/h3-9,14H,10-13H2,1-2H3