methyl 6-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-6-oxidanylidene-hexanoate Openeye Name: methyl 6-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-6-oxo-hexanoate CAS Name: 6-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-6-oxohexanoate Traditional Name: 6-keto-6-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]hexanoic acid methyl ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O6S/c1-27-19(24)7-4-3-6-17(22)20-12-5-13-21(20)18(23)14-15-8-10-16(11-9-15)28(2,25)26/h8-11H,3-7,12-14H2,1-2H3