2-methyl-1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 2-methyl-1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 2-methyl-1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 2-methyl-1-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 2-methyl-1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 1-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]-2-methyl-prop-2-en-1-one Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4S/c1-12(2)16(20)18-10-4-9-17(18)15(19)11-13-5-7-14(8-6-13)23(3,21)22/h5-8H,1,4,9-11H2,2-3H3