2-[[4-chloranyl-2-(phenylmethyl)phenoxy]methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-chloranyl-2-(phenylmethyl)phenoxy]methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(2-benzyl-4-chloro-phenoxy)methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[4-chloro-2-(phenylmethyl)phenoxy]methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(2-benzyl-4-chlorophenoxy)methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(2-benzyl-4-chloro-phenoxy)methyl]-8-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C23H20ClN2O2+ MolecularWeight: 391.8701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)COC3=C(C=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=[N+](C=C1)C(=O)C=C(N2)COC3=C(C=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H19ClN2O2/c1-16-9-10-26-22(11-16)25-20(14-23(26)27)15-28-21-8-7-19(24)13-18(21)12-17-5-3-2-4-6-17/h2-11,13-14H,12,15H2,1H3/p+1