3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)NC5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)NC5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C23H19N3O2/c27-22-18-7-3-4-8-19(18)24-20-10-9-16(13-21(20)25-22)23(28)26-12-11-15-5-1-2-6-17(15)14-26/h1-10,13,24H,11-12,14H2,(H,25,27)