(2E)-2-(2-oxidanylidenepropylidene)-1,5-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: (2E)-2-(2-oxidanylidenepropylidene)-1,5-dihydro-1,5-benzodiazepin-4-one Openeye Name: (2E)-2-acetonylidene-1,5-dihydro-1,5-benzodiazepin-4-one CAS Name: (2E)-2-(2-oxopropylidene)-1,5-dihydro-1,5-benzodiazepin-4-one IUPAC Name: (2E)-2-(2-oxopropylidene)-1,5-dihydro-1,5-benzodiazepin-4-one Traditional Name: (2E)-2-acetonylidene-1,5-dihydro-1,5-benzodiazepin-4-one Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=C1CC(=O)NC2=CC=CC=C2N1

Isomeric SMILES

CC(=O)/C=C/1\CC(=O)NC2=CC=CC=C2N1

InChI

InChI=1S/C12H12N2O2/c1-8(15)6-9-7-12(16)14-11-5-3-2-4-10(11)13-9/h2-6,13H,7H2,1H3,(H,14,16)/b9-6+