7-chloranyl-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide

Systemtic Name: 7-chloranyl-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide Openeye Name: 7-chloro-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide CAS Name: 7-chloro-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide IUPAC Name: 7-chloro-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide Traditional Name: 7-chloro-1-methyl-5-phenyl-3,5-dihydro-2H-1,4-benzodiazepin-4-ium 4-oxide Formula: C16H16ClN2O+ MolecularWeight: 287.76404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=O)C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CN1CC[N+](=O)C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H16ClN2O/c1-18-9-10-19(20)16(12-5-3-2-4-6-12)14-11-13(17)7-8-15(14)18/h2-8,11,16H,9-10H2,1H3/q+1