2-methyl-3-pyridin-1-ium-1-yl-4H-pyrrolo[2,1-b]quinazolin-9-one chloride

Systemtic Name: 2-methyl-3-pyridin-1-ium-1-yl-4H-pyrrolo[2,1-b]quinazolin-9-one chloride Openeye Name: 2-methyl-3-pyridin-1-ium-1-yl-4H-pyrrolo[2,1-b]quinazolin-9-one chloride CAS Name: 2-methyl-3-(1-pyridin-1-iumyl)-4H-pyrrolo[2,1-b]quinazolin-9-one chloride IUPAC Name: 2-methyl-3-pyridin-1-ium-1-yl-4H-pyrrolo[2,1-b]quinazolin-9-one chloride Traditional Name: 2-methyl-3-pyridin-1-ium-1-yl-4H-pyrrolo[2,1-b]quinazolin-9-one chloride Formula: C17H14ClN3O MolecularWeight: 311.76556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=C1[N+]3=CC=CC=C3)NC4=CC=CC=C4C2=O.[Cl-]

Isomeric SMILES

CC1=CN2C(=C1[N+]3=CC=CC=C3)NC4=CC=CC=C4C2=O.[Cl-]

InChI

InChI=1S/C17H13N3O.ClH/c1-12-11-20-16(15(12)19-9-5-2-6-10-19)18-14-8-4-3-7-13(14)17(20)21;/h2-11H,1H3;1H