(11bS)-13,13-dimethyl-7-oxidanylidene-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate

Systemtic Name: (11bS)-13,13-dimethyl-7-oxidanylidene-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate Openeye Name: (11bS)-13,13-dimethyl-7-oxo-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate CAS Name: (11bS)-13,13-dimethyl-7-oxo-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate IUPAC Name: (11bS)-13,13-dimethyl-7-oxo-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate Traditional Name: (11bS)-7-keto-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylate Formula: C20H18NO3- MolecularWeight: 320.36182

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C3=CC=CC(=C3C(=O)N2CC4=CC=CC=C41)C(=O)[O-])C

Isomeric SMILES

CC1(C[C@H]2C3=CC=CC(=C3C(=O)N2CC4=CC=CC=C41)C(=O)[O-])C

InChI

InChI=1S/C20H19NO3/c1-20(2)10-16-13-7-5-8-14(19(23)24)17(13)18(22)21(16)11-12-6-3-4-9-15(12)20/h3-9,16H,10-11H2,1-2H3,(H,23,24)/p-1/t16-/m0/s1