2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol

Systemtic Name: 2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol Openeye Name: 2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol CAS Name: 2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol Traditional Name: 2-[6-(3-methoxyphenyl)-2,2-dimethyl-3,4-dihydro-1H-pyrimidin-3-ium-4-yl]phenol Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC1([NH2+]C(C=C(N1)C2=CC(=CC=C2)OC)C3=CC=CC=C3O)C

Isomeric SMILES

CC1([NH2+]C(C=C(N1)C2=CC(=CC=C2)OC)C3=CC=CC=C3O)C

InChI

InChI=1S/C19H22N2O2/c1-19(2)20-16(13-7-6-8-14(11-13)23-3)12-17(21-19)15-9-4-5-10-18(15)22/h4-12,17,20-22H,1-3H3/p+1