3,4,11,12-tetramethoxy-14-(phenylsulfinyl)-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one

Systemtic Name: 3,4,11,12-tetramethoxy-14-(phenylsulfinyl)-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one Openeye Name: 14-(benzenesulfinyl)-3,4,11,12-tetramethoxy-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one CAS Name: 14-(benzenesulfinyl)-3,4,11,12-tetramethoxy-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one IUPAC Name: 14-(benzenesulfinyl)-3,4,11,12-tetramethoxy-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one Traditional Name: 14-(benzenesulfinyl)-3,4,11,12-tetramethoxy-8,9,14,14a-tetrahydro-5H-isoquinolino[1,2-b][3]benzazepin-6-one Formula: C28H29NO6S MolecularWeight: 507.59796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3C(C4=CC(=C(C=C4CCN3C(=O)C2)OC)OC)S(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C3C(C4=CC(=C(C=C4CCN3C(=O)C2)OC)OC)S(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C28H29NO6S/c1-32-22-11-10-19-21(27(22)35-4)16-25(30)29-13-12-17-14-23(33-2)24(34-3)15-20(17)28(26(19)29)36(31)18-8-6-5-7-9-18/h5-11,14-15,26,28H,12-13,16H2,1-4H3