6-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-2,3,4,7-tetrahydroazepine

Systemtic Name: 6-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-2,3,4,7-tetrahydroazepine Openeye Name: 6-(1-methyleneallyl)-1-(p-tolylsulfonyl)-2,3,4,7-tetrahydroazepine CAS Name: 6-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-2,3,4,7-tetrahydroazepine IUPAC Name: 6-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-2,3,4,7-tetrahydroazepine Traditional Name: 6-(1-methyleneallyl)-1-tosyl-2,3,4,7-tetrahydroazepine Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC=C(C2)C(=C)C=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC=C(C2)C(=C)C=C

InChI

InChI=1S/C17H21NO2S/c1-4-15(3)16-7-5-6-12-18(13-16)21(19,20)17-10-8-14(2)9-11-17/h4,7-11H,1,3,5-6,12-13H2,2H3