3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methyl-azanium dichloride

Systemtic Name: 3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methyl-azanium dichloride Openeye Name: 3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methyl-ammonium dichloride CAS Name: 3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methylammonium dichloride IUPAC Name: 3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methylazanium dichloride Traditional Name: 3-(6,11-dihydro-5H-benzo[b][1,4]benzodiazepin-5-ium-5-yl)propyl-methyl-ammonium dichloride Formula: C17H23Cl2N3 MolecularWeight: 340.29062

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC[NH+]1CC2=CC=CC=C2NC3=CC=CC=C31.[Cl-].[Cl-]

Isomeric SMILES

C[NH2+]CCC[NH+]1CC2=CC=CC=C2NC3=CC=CC=C31.[Cl-].[Cl-]

InChI

InChI=1S/C17H21N3.2ClH/c1-18-11-6-12-20-13-14-7-2-3-8-15(14)19-16-9-4-5-10-17(16)20;;/h2-5,7-10,18-19H,6,11-13H2,1H3;2*1H