(4S)-4-(3-chloranyl-5-cyclohexyl-2-oxidanyl-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: (4S)-4-(3-chloranyl-5-cyclohexyl-2-oxidanyl-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: (4S)-4-(3-chloro-5-cyclohexyl-2-hydroxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile CAS Name: (4S)-4-(3-chloro-5-cyclohexyl-2-hydroxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (4S)-4-(3-chloro-5-cyclohexyl-2-hydroxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: (4S)-4-(3-chloro-5-cyclohexyl-2-hydroxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C#N)C2=C(C(=CC(=C2)C3CCCCC3)Cl)O)C#N)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C#N)C2=C(C(=CC(=C2)C3CCCCC3)Cl)O)C#N)C

InChI

InChI=1S/C21H22ClN3O/c1-12-17(10-23)20(18(11-24)13(2)25-12)16-8-15(9-19(22)21(16)26)14-6-4-3-5-7-14/h8-9,14,17,20,26H,3-7H2,1-2H3/t17?,20-/m0/s1