2-azanyl-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(3-chlorophenyl)-4-(4-heptoxyphenyl)nicotinonitrile Formula: C25H26ClN3O MolecularWeight: 419.94644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C25H26ClN3O/c1-2-3-4-5-6-14-30-21-12-10-18(11-13-21)22-16-24(29-25(28)23(22)17-27)19-8-7-9-20(26)15-19/h7-13,15-16H,2-6,14H2,1H3,(H2,28,29)