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

Systemtic Name: 3-chloranyl-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Openeye Name: 3-chloro-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one CAS Name: 3-chloro-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one IUPAC Name: 3-chloro-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Traditional Name: 3-chloro-12,13-dimethoxy-7,9,10,14b-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-6-one Formula: C19H19ClN2O3 MolecularWeight: 358.81876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3C4=C(C=C(C=C4)Cl)NC(=O)CN3CCC2=C1)OC

Isomeric SMILES

COC1=C(C=C2C3C4=C(C=C(C=C4)Cl)NC(=O)CN3CCC2=C1)OC

InChI

InChI=1S/C19H19ClN2O3/c1-24-16-7-11-5-6-22-10-18(23)21-15-8-12(20)3-4-13(15)19(22)14(11)9-17(16)25-2/h3-4,7-9,19H,5-6,10H2,1-2H3,(H,21,23)