3-(2-chloranylethanoyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one

Systemtic Name: 3-(2-chloranylethanoyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one Openeye Name: 3-(2-chloroacetyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one CAS Name: 3-(2-chloro-1-oxoethyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one IUPAC Name: 3-(2-chloroacetyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one Traditional Name: 3-(2-chloroacetyl)-13,13-dimethyl-11b,12-dihydro-5H-isoindolo[2,3-b][2]benzazepin-7-one Formula: C21H20ClNO2 MolecularWeight: 353.842

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C3=CC=CC=C3C(=O)N2CC4=C1C=CC(=C4)C(=O)CCl)C

Isomeric SMILES

CC1(CC2C3=CC=CC=C3C(=O)N2CC4=C1C=CC(=C4)C(=O)CCl)C

InChI

InChI=1S/C21H20ClNO2/c1-21(2)10-18-15-5-3-4-6-16(15)20(25)23(18)12-14-9-13(19(24)11-22)7-8-17(14)21/h3-9,18H,10-12H2,1-2H3