12,13-dimethoxy-7-propan-2-yl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one

Systemtic Name: 12,13-dimethoxy-7-propan-2-yl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Openeye Name: 7-isopropyl-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one CAS Name: 12,13-dimethoxy-7-propan-2-yl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one IUPAC Name: 12,13-dimethoxy-7-propan-2-yl-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Traditional Name: 7-isopropyl-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC2=CC=CC=C2C3N1CCC4=CC(=C(C=C34)OC)OC

Isomeric SMILES

CC(C)C1C(=O)NC2=CC=CC=C2C3N1CCC4=CC(=C(C=C34)OC)OC

InChI

InChI=1S/C22H26N2O3/c1-13(2)20-22(25)23-17-8-6-5-7-15(17)21-16-12-19(27-4)18(26-3)11-14(16)9-10-24(20)21/h5-8,11-13,20-21H,9-10H2,1-4H3,(H,23,25)