ethyl 2-azanyl-4-diazanyl-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-diazanyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-amino-4-hydrazino-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-amino-4-hydrazinyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-hydrazinyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-amino-4-hydrazino-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C12H15N5O2 MolecularWeight: 261.2798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1NN)N

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1NN)N

InChI

InChI=1S/C12H15N5O2/c1-2-19-12(18)9-10(13)15-7-5-3-4-6-8(7)16-11(9)17-14/h3-6,15H,2,13-14H2,1H3,(H,16,17)