(6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one

Systemtic Name: (6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Openeye Name: (6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one CAS Name: (6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one IUPAC Name: (6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Traditional Name: (6aS)-2,3-dimethoxy-8-(4-methoxyphenyl)-6a,9-dihydropyrrolo[2,1-c][1,4]benzodiazepin-11-one Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC3C=NC4=CC(=C(C=C4C(=O)N3C2)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C[C@H]3C=NC4=CC(=C(C=C4C(=O)N3C2)OC)OC

InChI

InChI=1S/C21H20N2O4/c1-25-16-6-4-13(5-7-16)14-8-15-11-22-18-10-20(27-3)19(26-2)9-17(18)21(24)23(15)12-14/h4-11,15H,12H2,1-3H3/t15-/m0/s1