3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride

Systemtic Name: 3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride Openeye Name: 3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride CAS Name: 3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride IUPAC Name: 3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride Traditional Name: 3-ethyl-2-[2-(4-nitrophenyl)ethyl]-1,5-dihydro-2,4-benzodiazepine hydrochloride Formula: C19H22ClN3O2 MolecularWeight: 359.84988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NCC2=CC=CC=C2CN1CCC3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CCC1=NCC2=CC=CC=C2CN1CCC3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H21N3O2.ClH/c1-2-19-20-13-16-5-3-4-6-17(16)14-21(19)12-11-15-7-9-18(10-8-15)22(23)24;/h3-10H,2,11-14H2,1H3;1H