7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one

Systemtic Name: 7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one Openeye Name: 7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one CAS Name: 7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one IUPAC Name: 7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one Traditional Name: 7-methyl-3-phenyl-1H-pyrido[2,1-b]purin-10-ium-2-one Formula: C16H13N4O+ MolecularWeight: 277.30062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC=C3C(=[N+]2C=C1)NC(=O)N3C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=NC=C3C(=[N+]2C=C1)NC(=O)N3C4=CC=CC=C4

InChI

InChI=1S/C16H12N4O/c1-11-7-8-19-14(9-11)17-10-13-15(19)18-16(21)20(13)12-5-3-2-4-6-12/h2-10H,1H3/p+1