(6aS)-9,9-dimethyl-4-propanoyl-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: (6aS)-9,9-dimethyl-4-propanoyl-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one Openeye Name: (6aS)-9,9-dimethyl-4-propanoyl-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one CAS Name: (6aS)-9,9-dimethyl-4-(1-oxopropyl)-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: (6aS)-9,9-dimethyl-4-propanoyl-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one Traditional Name: (6aS)-9,9-dimethyl-4-propionyl-8,10-dihydro-6aH-benzo[b][1,4]benzodiazepin-7-one Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C2C(=CC=C1)N=C3CC(CC(=O)C3C=N2)(C)C

Isomeric SMILES

CCC(=O)C1=C2C(=CC=C1)N=C3CC(CC(=O)[C@H]3C=N2)(C)C

InChI

InChI=1S/C18H20N2O2/c1-4-15(21)11-6-5-7-13-17(11)19-10-12-14(20-13)8-18(2,3)9-16(12)22/h5-7,10,12H,4,8-9H2,1-3H3/t12-/m0/s1