(6R)-9,9-dimethyl-6-(5-nitrofuran-2-yl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: (6R)-9,9-dimethyl-6-(5-nitrofuran-2-yl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: (6R)-9,9-dimethyl-6-(5-nitro-2-furyl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: (6R)-9,9-dimethyl-6-(5-nitro-2-furanyl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: (6R)-9,9-dimethyl-6-(5-nitrofuran-2-yl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: (6R)-9,9-dimethyl-6-(5-nitro-2-furyl)-6,6a,8,10-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=NC3=CC=CC=C3NC(C2C(=O)C1)C4=CC=C(O4)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC2=NC3=CC=CC=C3N[C@H](C2C(=O)C1)C4=CC=C(O4)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O4/c1-19(2)9-13-17(14(23)10-19)18(15-7-8-16(26-15)22(24)25)21-12-6-4-3-5-11(12)20-13/h3-8,17-18,21H,9-10H2,1-2H3/t17?,18-/m0/s1