methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid methyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5S/c1-11(17)15-7-9-16(10-8-15)22(19,20)13-5-3-12(4-6-13)14(18)21-2/h3-6H,7-10H2,1-2H3