4-(6-bromanyl-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile

Systemtic Name: 4-(6-bromanyl-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile Openeye Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile CAS Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile IUPAC Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile Traditional Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile Formula: C16H12BrN3O2 MolecularWeight: 358.18938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C#N)C2=CC3=C(C=C2Br)OCO3)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C#N)C2=CC3=C(C=C2Br)OCO3)C#N

InChI

InChI=1S/C16H12BrN3O2/c1-8-11(5-18)16(12(6-19)9(2)20-8)10-3-14-15(4-13(10)17)22-7-21-14/h3-4,16,20H,7H2,1-2H3