(4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-(4-methylphenyl)sulfonyl-2,6-dihydro-1H-3-benzazocine

Systemtic Name: (4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-(4-methylphenyl)sulfonyl-2,6-dihydro-1H-3-benzazocine Openeye Name: (4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-(p-tolylsulfonyl)-2,6-dihydro-1H-3-benzazocine CAS Name: (4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-(4-methylphenyl)sulfonyl-2,6-dihydro-1H-3-benzazocine IUPAC Name: (4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-(4-methylphenyl)sulfonyl-2,6-dihydro-1H-3-benzazocine Traditional Name: (4E)-3-ethyl-6-(4-fluorophenyl)-8,9-dimethoxy-5-tosyl-2,6-dihydro-1H-3-benzazocine Formula: C28H30FNO4S MolecularWeight: 495.605503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=CC(=C(C=C2C(C(=C1)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)F)OC)OC

Isomeric SMILES

CCN/1CCC2=CC(=C(C=C2C(/C(=C1)/S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)F)OC)OC

InChI

InChI=1S/C28H30FNO4S/c1-5-30-15-14-21-16-25(33-3)26(34-4)17-24(21)28(20-8-10-22(29)11-9-20)27(18-30)35(31,32)23-12-6-19(2)7-13-23/h6-13,16-18,28H,5,14-15H2,1-4H3/b27-18+