2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-[1-(p-tolylsulfonyl)pyrrol-3-yl]cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]cyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-(1-tosylpyrrol-3-yl)cyclohex-2-en-1-one Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C3=C(CCCC3=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C3=C(CCCC3=O)O

InChI

InChI=1S/C17H17NO4S/c1-12-5-7-14(8-6-12)23(21,22)18-10-9-13(11-18)17-15(19)3-2-4-16(17)20/h5-11,19H,2-4H2,1H3