(4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: (4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile CAS Name: (4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: (4S)-4-(4-hexoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2C(C(=NC(=C2C#N)C)C)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)[C@@H]2C(C(=NC(=C2C#N)C)C)C#N

InChI

InChI=1S/C21H25N3O/c1-4-5-6-7-12-25-18-10-8-17(9-11-18)21-19(13-22)15(2)24-16(3)20(21)14-23/h8-11,19,21H,4-7,12H2,1-3H3/t19?,21-/m1/s1