3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonyl-azepane

Systemtic Name: 3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonyl-azepane Openeye Name: 3-(4-chlorophenyl)-1-(p-tolylsulfonyl)azepane CAS Name: 3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonylazepane IUPAC Name: 3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonylazepane Traditional Name: 3-(4-chlorophenyl)-1-tosyl-azepane Formula: C19H22ClNO2S MolecularWeight: 363.90148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClNO2S/c1-15-5-11-19(12-6-15)24(22,23)21-13-3-2-4-17(14-21)16-7-9-18(20)10-8-16/h5-12,17H,2-4,13-14H2,1H3