2-[6-(3,4-dimethoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol

Systemtic Name: 2-[6-(3,4-dimethoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 2-[6-(3,4-dimethoxyphenyl)-2-isopropyl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 2-[6-(3,4-dimethoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-[6-(3,4-dimethoxyphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 2-[6-(3,4-dimethoxyphenyl)-2-isopropyl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1[NH2+]C(C=C(N1)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3O

Isomeric SMILES

CC(C)C1[NH2+]C(C=C(N1)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3O

InChI

InChI=1S/C21H26N2O3/c1-13(2)21-22-16(14-9-10-19(25-3)20(11-14)26-4)12-17(23-21)15-7-5-6-8-18(15)24/h5-13,17,21-24H,1-4H3/p+1