2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C19H18N3O2+ MolecularWeight: 320.36512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=C(C2=O)C=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=C(C2=O)C=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H17N3O2/c1-13-6-7-17-20-18(16(12-23)19(24)22(17)10-13)21-9-8-14-4-2-3-5-15(14)11-21/h2-7,10,12H,8-9,11H2,1H3/p+1