2-[(4-chloranyl-2-cyclohexyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(4-chloranyl-2-cyclohexyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-chloro-2-cyclohexyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(4-chloro-2-cyclohexylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(4-chloro-2-cyclohexylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-chloro-2-cyclohexyl-phenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H24ClN2O2+ MolecularWeight: 383.89116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=C(C=C(C=C3)Cl)C4CCCCC4

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=C(C=C(C=C3)Cl)C4CCCCC4

InChI

InChI=1S/C22H23ClN2O2/c1-15-7-10-21-24-18(12-22(26)25(21)13-15)14-27-20-9-8-17(23)11-19(20)16-5-3-2-4-6-16/h7-13,16H,2-6,14H2,1H3/p+1