8-chloranyl-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide

Systemtic Name: 8-chloranyl-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide Openeye Name: 8-chloro-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide CAS Name: 8-chloro-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide IUPAC Name: 8-chloro-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide Traditional Name: 8-chloro-1,11-dimethyl-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepin-11-ium-3-carboxamide Formula: C20H18ClN4O+ MolecularWeight: 365.83612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2[N+]1(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4)C)C(=O)N

Isomeric SMILES

CC1=NC(=C2[N+]1(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4)C)C(=O)N

InChI

InChI=1S/C20H17ClN4O/c1-12-24-19(20(22)26)17-11-23-18(13-6-4-3-5-7-13)15-10-14(21)8-9-16(15)25(12,17)2/h3-10H,11H2,1-2H3,(H-,22,26)/p+1