2,6-dimethyl-5-phenyl-1-(2-piperidin-1-ium-1-ylethyl)pyrimidin-4-one

Systemtic Name: 2,6-dimethyl-5-phenyl-1-(2-piperidin-1-ium-1-ylethyl)pyrimidin-4-one Openeye Name: 2,6-dimethyl-5-phenyl-1-(2-piperidin-1-ium-1-ylethyl)pyrimidin-4-one CAS Name: 2,6-dimethyl-5-phenyl-1-[2-(1-piperidin-1-iumyl)ethyl]-4-pyrimidinone IUPAC Name: 2,6-dimethyl-5-phenyl-1-(2-piperidin-1-ium-1-ylethyl)pyrimidin-4-one Traditional Name: 2,6-dimethyl-5-phenyl-1-(2-piperidin-1-ium-1-ylethyl)pyrimidin-4-one Formula: C19H26N3O+ MolecularWeight: 312.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1CC[NH+]2CCCCC2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1CC[NH+]2CCCCC2)C)C3=CC=CC=C3

InChI

InChI=1S/C19H25N3O/c1-15-18(17-9-5-3-6-10-17)19(23)20-16(2)22(15)14-13-21-11-7-4-8-12-21/h3,5-6,9-10H,4,7-8,11-14H2,1-2H3/p+1