cyanomethyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: cyanomethyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: cyanomethyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid cyanomethyl ester Formula: C15H17N3O5S MolecularWeight: 351.37758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC#N

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC#N

InChI

InChI=1S/C15H17N3O5S/c1-12(19)17-6-8-18(9-7-17)24(21,22)14-4-2-3-13(11-14)15(20)23-10-5-16/h2-4,11H,6-10H2,1H3