2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride

Systemtic Name: 2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride Openeye Name: 2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride CAS Name: 2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride IUPAC Name: 2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride Traditional Name: 2-(chloromethyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine hydrochloride Formula: C16H15Cl2N3O2 MolecularWeight: 352.2152

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)CCl.Cl

Isomeric SMILES

C1C(NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)CCl.Cl

InChI

InChI=1S/C16H14ClN3O2.ClH/c17-9-12-10-18-16(11-4-2-1-3-5-11)14-8-13(20(21)22)6-7-15(14)19-12;/h1-8,12,19H,9-10H2;1H