7-chloranyl-5-phenyl-3-pyridin-1-ium-1-yl-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-phenyl-3-pyridin-1-ium-1-yl-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-phenyl-3-(1-pyridin-1-iumyl)-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-phenyl-3-pyridin-1-ium-1-yl-1,4-benzodiazepin-2-one Formula: C20H13ClN3O+ MolecularWeight: 346.78972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)C(=N2)[N+]4=CC=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)C(=N2)[N+]4=CC=CC=C4)Cl

InChI

InChI=1S/C20H13ClN3O/c21-15-9-10-17-16(13-15)18(14-7-3-1-4-8-14)23-19(20(25)22-17)24-11-5-2-6-12-24/h1-13H/q+1