8-chloranyl-1-methyl-5-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine

Systemtic Name: 8-chloranyl-1-methyl-5-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine Openeye Name: 5-[(E)-2-(3-benzyloxyphenyl)vinyl]-8-chloro-1-methyl-2,3-dihydro-1,4-benzodiazepine CAS Name: 8-chloro-1-methyl-5-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine IUPAC Name: 8-chloro-1-methyl-5-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine Traditional Name: 5-[(E)-2-(3-benzoxyphenyl)vinyl]-8-chloro-1-methyl-2,3-dihydro-1,4-benzodiazepine Formula: C25H23ClN2O MolecularWeight: 402.91592

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=C1C=C(C=C2)Cl)C=CC3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN1CCN=C(C2=C1C=C(C=C2)Cl)/C=C/C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23ClN2O/c1-28-15-14-27-24(23-12-11-21(26)17-25(23)28)13-10-19-8-5-9-22(16-19)29-18-20-6-3-2-4-7-20/h2-13,16-17H,14-15,18H2,1H3/b13-10+