1-(4-methylphenyl)sulfonyl-5,6-dihydro-2H-azepin-7-one

Systemtic Name: 1-(4-methylphenyl)sulfonyl-5,6-dihydro-2H-azepin-7-one Openeye Name: 1-(p-tolylsulfonyl)-5,6-dihydro-2H-azepin-7-one CAS Name: 1-(4-methylphenyl)sulfonyl-5,6-dihydro-2H-azepin-7-one IUPAC Name: 1-(4-methylphenyl)sulfonyl-5,6-dihydro-2H-azepin-7-one Traditional Name: 1-tosyl-5,6-dihydro-2H-azepin-7-one Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC=CCCC2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC=CCCC2=O

InChI

InChI=1S/C13H15NO3S/c1-11-6-8-12(9-7-11)18(16,17)14-10-4-2-3-5-13(14)15/h2,4,6-9H,3,5,10H2,1H3