2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]benzoate dihydrochloride

Systemtic Name: 2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]benzoate dihydrochloride Openeye Name: 2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)vinyl]benzoate dihydrochloride CAS Name: 2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]benzoate dihydrochloride IUPAC Name: 2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)ethenyl]benzoate dihydrochloride Traditional Name: 2-[(E)-2-(1-methyl-2,3-dihydro-1,4-benzodiazepin-5-yl)vinyl]benzoate dihydrochloride Formula: C19H19Cl2N2O2- MolecularWeight: 378.27236

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=CC=CC=C21)C=CC3=CC=CC=C3C(=O)[O-].Cl.Cl

Isomeric SMILES

CN1CCN=C(C2=CC=CC=C21)/C=C/C3=CC=CC=C3C(=O)[O-].Cl.Cl

InChI

InChI=1S/C19H18N2O2.2ClH/c1-21-13-12-20-17(16-8-4-5-9-18(16)21)11-10-14-6-2-3-7-15(14)19(22)23;;/h2-11H,12-13H2,1H3,(H,22,23);2*1H/p-1/b11-10+;;