(4E)-5-bromanyl-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazocin-6-one

Systemtic Name: (4E)-5-bromanyl-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazocin-6-one Openeye Name: (4E)-5-bromo-1-(p-tolylsulfonyl)-2,3-dihydro-1-benzazocin-6-one CAS Name: (4E)-5-bromo-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazocin-6-one IUPAC Name: (4E)-5-bromo-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazocin-6-one Traditional Name: (4E)-5-bromo-1-tosyl-2,3-dihydro-1-benzazocin-6-one Formula: C18H16BrNO3S MolecularWeight: 406.29354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC=C(C(=O)C3=CC=CC=C32)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC/C=C(\C(=O)C3=CC=CC=C32)/Br

InChI

InChI=1S/C18H16BrNO3S/c1-13-8-10-14(11-9-13)24(22,23)20-12-4-6-16(19)18(21)15-5-2-3-7-17(15)20/h2-3,5-11H,4,12H2,1H3/b16-6+