4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Openeye Name: 4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine CAS Name: 4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Traditional Name: 4-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Formula: C23H21FN2O2 MolecularWeight: 376.423443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3NC(C2)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3NC(C2)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C23H21FN2O2/c1-27-22-12-9-16(13-23(22)28-2)21-14-20(15-7-10-17(24)11-8-15)25-18-5-3-4-6-19(18)26-21/h3-13,20,25H,14H2,1-2H3