6-methyl-2-[3-(morpholin-4-ium-4-ylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[3-(morpholin-4-ium-4-ylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[3-(morpholin-4-ium-4-ylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[3-(4-morpholin-4-iumylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[3-(morpholin-4-ium-4-ylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-[3-(morpholin-4-ium-4-ylmethyl)phenyl]-5-phenyl-1H-pyrimidin-4-one Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC(=CC=C2)C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC(=CC=C2)C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2/c1-16-20(18-7-3-2-4-8-18)22(26)24-21(23-16)19-9-5-6-17(14-19)15-25-10-12-27-13-11-25/h2-9,14H,10-13,15H2,1H3,(H,23,24,26)/p+1