5-[(E)-2-(3,4-dichlorophenyl)ethenyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide

Systemtic Name: 5-[(E)-2-(3,4-dichlorophenyl)ethenyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide Openeye Name: 5-[(E)-2-(3,4-dichlorophenyl)vinyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide CAS Name: 5-[(E)-2-(3,4-dichlorophenyl)ethenyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide IUPAC Name: 5-[(E)-2-(3,4-dichlorophenyl)ethenyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide Traditional Name: 5-[(E)-2-(3,4-dichlorophenyl)vinyl]-N-ethyl-2,3-dihydro-1,4-benzodiazepine-1-carboxamide Formula: C20H19Cl2N3O MolecularWeight: 388.29036

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN=C(C2=CC=CC=C21)C=CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCNC(=O)N1CCN=C(C2=CC=CC=C21)/C=C/C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3O/c1-2-23-20(26)25-12-11-24-18(15-5-3-4-6-19(15)25)10-8-14-7-9-16(21)17(22)13-14/h3-10,13H,2,11-12H2,1H3,(H,23,26)/b10-8+