7,8-diethoxy-5-ethyl-4-methyl-1-[(E)-3-phenylprop-2-enyl]-5H-2,3-benzodiazepine

Systemtic Name: 7,8-diethoxy-5-ethyl-4-methyl-1-[(E)-3-phenylprop-2-enyl]-5H-2,3-benzodiazepine Openeye Name: 1-[(E)-cinnamyl]-7,8-diethoxy-5-ethyl-4-methyl-5H-2,3-benzodiazepine CAS Name: 7,8-diethoxy-5-ethyl-4-methyl-1-[(E)-3-phenylprop-2-enyl]-5H-2,3-benzodiazepine IUPAC Name: 7,8-diethoxy-5-ethyl-4-methyl-1-[(E)-3-phenylprop-2-enyl]-5H-2,3-benzodiazepine Traditional Name: 1-[(E)-cinnamyl]-7,8-diethoxy-5-ethyl-4-methyl-5H-2,3-benzodiazepine Formula: C25H30N2O2 MolecularWeight: 390.5179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN=C(C2=CC(=C(C=C12)OCC)OCC)CC=CC3=CC=CC=C3)C

Isomeric SMILES

CCC1C(=NN=C(C2=CC(=C(C=C12)OCC)OCC)C/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C25H30N2O2/c1-5-20-18(4)26-27-23(15-11-14-19-12-9-8-10-13-19)22-17-25(29-7-3)24(28-6-2)16-21(20)22/h8-14,16-17,20H,5-7,15H2,1-4H3/b14-11+