7-chloranyl-5-phenyl-3-pyridin-1-ium-1-yl-2,3-dihydro-1H-1,4-benzodiazepine

Systemtic Name: 7-chloranyl-5-phenyl-3-pyridin-1-ium-1-yl-2,3-dihydro-1H-1,4-benzodiazepine Openeye Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-2,3-dihydro-1H-1,4-benzodiazepine CAS Name: 7-chloro-5-phenyl-3-(1-pyridin-1-iumyl)-2,3-dihydro-1H-1,4-benzodiazepine IUPAC Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-2,3-dihydro-1H-1,4-benzodiazepine Traditional Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-2,3-dihydro-1H-1,4-benzodiazepine Formula: C20H17ClN3+ MolecularWeight: 334.82208

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3)[N+]4=CC=CC=C4

Isomeric SMILES

C1C(N=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3)[N+]4=CC=CC=C4

InChI

InChI=1S/C20H17ClN3/c21-16-9-10-18-17(13-16)20(15-7-3-1-4-8-15)23-19(14-22-18)24-11-5-2-6-12-24/h1-13,19,22H,14H2/q+1