2-methyl-3-pyrrol-1-yl-4aH-quinazolin-3-ium-4-one

Systemtic Name: 2-methyl-3-pyrrol-1-yl-4aH-quinazolin-3-ium-4-one Openeye Name: 2-methyl-3-pyrrol-1-yl-4aH-quinazolin-3-ium-4-one CAS Name: 2-methyl-3-(1-pyrrolyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 2-methyl-3-pyrrol-1-yl-4aH-quinazolin-3-ium-4-one Traditional Name: 2-methyl-3-pyrrol-1-yl-4aH-quinazolin-3-ium-4-one Formula: C13H12N3O+ MolecularWeight: 226.25388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2C=CC=CC2=N1)N3C=CC=C3

Isomeric SMILES

CC1=[N+](C(=O)C2C=CC=CC2=N1)N3C=CC=C3

InChI

InChI=1S/C13H12N3O/c1-10-14-12-7-3-2-6-11(12)13(17)16(10)15-8-4-5-9-15/h2-9,11H,1H3/q+1