(3E)-3-(butylaminomethylidene)-7-chloranyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione

Systemtic Name: (3E)-3-(butylaminomethylidene)-7-chloranyl-1,5-dihydro-1,5-benzodiazepine-2,4-dione Openeye Name: (3E)-3-(butylaminomethylene)-7-chloro-1,5-dihydro-1,5-benzodiazepine-2,4-dione CAS Name: (3E)-3-(butylaminomethylidene)-7-chloro-1,5-dihydro-1,5-benzodiazepine-2,4-dione IUPAC Name: (3E)-3-(butylaminomethylidene)-7-chloro-1,5-dihydro-1,5-benzodiazepine-2,4-dione Traditional Name: (3E)-3-(butylaminomethylene)-7-chloro-1,5-dihydro-1,5-benzodiazepine-2,4-quinone Formula: C14H16ClN3O2 MolecularWeight: 293.74874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC=C1C(=O)NC2=C(C=C(C=C2)Cl)NC1=O

Isomeric SMILES

CCCCN/C=C/1\C(=O)NC2=C(C=C(C=C2)Cl)NC1=O

InChI

InChI=1S/C14H16ClN3O2/c1-2-3-6-16-8-10-13(19)17-11-5-4-9(15)7-12(11)18-14(10)20/h4-5,7-8,16H,2-3,6H2,1H3,(H,17,19)(H,18,20)/b10-8+