(4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-amine

Systemtic Name: (4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-amine Openeye Name: (4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-amine CAS Name: (4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-amine IUPAC Name: (4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-amine Traditional Name: [(4S)-6-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4,5-dihydropyrimidin-3-ium-2-yl]amine Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NC(=[NH+]2)N)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CC(=NC(=[NH+]2)N)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C19H21N3O3/c1-23-14-6-4-12(5-7-14)17-11-18(22-19(20)21-17)13-8-15(24-2)10-16(9-13)25-3/h4-10,17H,11H2,1-3H3,(H2,20,21)/p+1/t17-/m0/s1