2-azanyl-5,6-dimethyl-4-(4-octoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-5,6-dimethyl-4-(4-octoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-5,6-dimethyl-4-(4-octoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-5,6-dimethyl-4-(4-octoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-5,6-dimethyl-4-(4-octoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-5,6-dimethyl-4-(4-octoxyphenyl)nicotinonitrile Formula: C22H29N3O MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O/c1-4-5-6-7-8-9-14-26-19-12-10-18(11-13-19)21-16(2)17(3)25-22(24)20(21)15-23/h10-13H,4-9,14H2,1-3H3,(H2,24,25)