2-[6-(4-ethoxyphenyl)-2-methyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol

Systemtic Name: 2-[6-(4-ethoxyphenyl)-2-methyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol Openeye Name: 2-[6-(4-ethoxyphenyl)-2-methyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol CAS Name: 2-[6-(4-ethoxyphenyl)-2-methyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-[6-(4-ethoxyphenyl)-2-methyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol Traditional Name: 2-(2-methyl-6-p-phenetyl-2-propyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl)phenol Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1([NH2+]C(C=C(N1)C2=CC=C(C=C2)OCC)C3=CC=CC=C3O)C

Isomeric SMILES

CCCC1([NH2+]C(C=C(N1)C2=CC=C(C=C2)OCC)C3=CC=CC=C3O)C

InChI

InChI=1S/C22H28N2O2/c1-4-14-22(3)23-19(16-10-12-17(13-11-16)26-5-2)15-20(24-22)18-8-6-7-9-21(18)25/h6-13,15,20,23-25H,4-5,14H2,1-3H3/p+1