(3R,4S)-2-azanyl-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile

Systemtic Name: (3R,4S)-2-azanyl-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile Openeye Name: (3R,4S)-2-amino-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile CAS Name: (3R,4S)-2-amino-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile IUPAC Name: (3R,4S)-2-amino-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile Traditional Name: (3R,4S)-2-amino-6-(4-methoxyphenyl)-4-phenyl-3,4-dihydropyridin-1-ium-3-carbonitrile Formula: C19H18N3O+ MolecularWeight: 304.36572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(C(C(=[NH+]2)N)C#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=C[C@@H]([C@@H](C(=[NH+]2)N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O/c1-23-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(21)22-18/h2-11,16-17H,1H3,(H2,21,22)/p+1/t16-,17+/m1/s1