4-oxidanylidene-5-(2-oxidanylidenepropyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde

Systemtic Name: 4-oxidanylidene-5-(2-oxidanylidenepropyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-acetonyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 4-oxo-5-(2-oxopropyl)-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 4-oxo-5-(2-oxopropyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-acetonyl-4-keto-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C13H14N2O3 MolecularWeight: 246.26186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)CCN(C2=CC=CC=C21)C=O

Isomeric SMILES

CC(=O)CN1C(=O)CCN(C2=CC=CC=C21)C=O

InChI

InChI=1S/C13H14N2O3/c1-10(17)8-15-12-5-3-2-4-11(12)14(9-16)7-6-13(15)18/h2-5,9H,6-8H2,1H3