1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]pent-3-en-1-one

Systemtic Name: 1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]pent-3-en-1-one Openeye Name: 1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]pent-3-en-1-one CAS Name: 1-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-3-penten-1-one IUPAC Name: 1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]pent-3-en-1-one Traditional Name: 1-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]pent-3-en-1-one Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC=CCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H22N2O4S/c1-3-4-6-16(20)18-11-5-12-19(18)17(21)13-14-7-9-15(10-8-14)24(2,22)23/h3-4,7-10H,5-6,11-13H2,1-2H3