(7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one

Systemtic Name: (7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Openeye Name: (7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one CAS Name: (7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one IUPAC Name: (7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Traditional Name: (7aS)-10,11-dimethoxy-6-phenyl-5,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Formula: C24H20N2O3 MolecularWeight: 384.4272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3C=C(NC4=CC=CC=C4N3C2=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@@H]3C=C(NC4=CC=CC=C4N3C2=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C24H20N2O3/c1-28-21-13-12-16-20-14-18(15-8-4-3-5-9-15)25-17-10-6-7-11-19(17)26(20)24(27)22(16)23(21)29-2/h3-14,20,25H,1-2H3/t20-/m0/s1