methyl 3-[[4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonyloxymethyl]benzoate

Systemtic Name: methyl 3-[[4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonyloxymethyl]benzoate Openeye Name: methyl 3-[[4-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]oxymethyl]benzoate CAS Name: 3-[[[4-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]-oxomethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]oxymethyl]benzoate Traditional Name: 3-[[4-(4-acetylpiperazino)sulfonylbenzoyl]oxymethyl]benzoic acid methyl ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O7S/c1-16(25)23-10-12-24(13-11-23)32(28,29)20-8-6-18(7-9-20)22(27)31-15-17-4-3-5-19(14-17)21(26)30-2/h3-9,14H,10-13,15H2,1-2H3