2-[4-azanyl-5-(ethoxymethyl)-2-methyl-pyrimidin-1-ium-1-yl]-1-(4-ethylphenyl)ethanone

Systemtic Name: 2-[4-azanyl-5-(ethoxymethyl)-2-methyl-pyrimidin-1-ium-1-yl]-1-(4-ethylphenyl)ethanone Openeye Name: 2-[4-amino-5-(ethoxymethyl)-2-methyl-pyrimidin-1-ium-1-yl]-1-(4-ethylphenyl)ethanone CAS Name: 2-[4-amino-5-(ethoxymethyl)-2-methyl-1-pyrimidin-1-iumyl]-1-(4-ethylphenyl)ethanone IUPAC Name: 2-[4-amino-5-(ethoxymethyl)-2-methylpyrimidin-1-ium-1-yl]-1-(4-ethylphenyl)ethanone Traditional Name: 2-[4-amino-5-(ethoxymethyl)-2-methyl-pyrimidin-1-ium-1-yl]-1-(4-ethylphenyl)ethanone Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C[N+]2=C(N=C(C(=C2)COCC)N)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C[N+]2=C(N=C(C(=C2)COCC)N)C

InChI

InChI=1S/C18H23N3O2/c1-4-14-6-8-15(9-7-14)17(22)11-21-10-16(12-23-5-2)18(19)20-13(21)3/h6-10,19H,4-5,11-12H2,1-3H3/p+1