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

Systemtic Name: (4S)-4-(5-bromanyl-2-oxidanyl-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: (4S)-4-(5-bromo-2-hydroxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile CAS Name: (4S)-4-(5-bromo-2-hydroxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: (4S)-4-(5-bromo-2-hydroxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: (4S)-4-(5-bromo-2-hydroxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile Formula: C15H12BrN3O MolecularWeight: 330.17928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrN3O/c1-8-12(6-17)15(13(7-18)9(2)19-8)11-5-10(16)3-4-14(11)20/h3-5,12,15,20H,1-2H3/t12?,15-/m0/s1