2-azanyl-6-(3-bromophenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(3-bromophenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(3-bromophenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(3-bromophenyl)-4-(4-octoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(3-bromophenyl)-4-(4-octoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(3-bromophenyl)-4-(4-octoxyphenyl)nicotinonitrile Formula: C26H28BrN3O MolecularWeight: 478.42402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C26H28BrN3O/c1-2-3-4-5-6-7-15-31-22-13-11-19(12-14-22)23-17-25(30-26(29)24(23)18-28)20-9-8-10-21(27)16-20/h8-14,16-17H,2-7,15H2,1H3,(H2,29,30)