1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone

Systemtic Name: 1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone Openeye Name: 1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone CAS Name: 1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone IUPAC Name: 1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone Traditional Name: 1-[(2S,6R)-4-methyl-2,6-diphenyl-1,2,5,6-tetrahydropyrimidin-1-ium-5-yl]ethanone Formula: C19H21N2O+ MolecularWeight: 293.38284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC([NH2+]C(C1C(=O)C)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=N[C@H]([NH2+][C@H](C1C(=O)C)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O/c1-13-17(14(2)22)18(15-9-5-3-6-10-15)21-19(20-13)16-11-7-4-8-12-16/h3-12,17-19,21H,1-2H3/p+1/t17?,18-,19+/m0/s1