1-methyl-5-[(E)-2-[2-(naphthalen-2-ylmethoxy)phenyl]ethenyl]-2,3-dihydro-1,4-benzodiazepine

Systemtic Name: 1-methyl-5-[(E)-2-[2-(naphthalen-2-ylmethoxy)phenyl]ethenyl]-2,3-dihydro-1,4-benzodiazepine Openeye Name: 1-methyl-5-[(E)-2-[2-(2-naphthylmethoxy)phenyl]vinyl]-2,3-dihydro-1,4-benzodiazepine CAS Name: 1-methyl-5-[(E)-2-[2-(2-naphthalenylmethoxy)phenyl]ethenyl]-2,3-dihydro-1,4-benzodiazepine IUPAC Name: 1-methyl-5-[(E)-2-[2-(naphthalen-2-ylmethoxy)phenyl]ethenyl]-2,3-dihydro-1,4-benzodiazepine Traditional Name: 1-methyl-5-[(E)-2-[2-(2-naphthylmethoxy)phenyl]vinyl]-2,3-dihydro-1,4-benzodiazepine Formula: C29H26N2O MolecularWeight: 418.52954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=CC=CC=C21)C=CC3=CC=CC=C3OCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN1CCN=C(C2=CC=CC=C21)/C=C/C3=CC=CC=C3OCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H26N2O/c1-31-19-18-30-27(26-11-5-6-12-28(26)31)17-16-24-9-4-7-13-29(24)32-21-22-14-15-23-8-2-3-10-25(23)20-22/h2-17,20H,18-19,21H2,1H3/b17-16+