2-azanyl-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-(3,4-dimethoxyphenyl)-4-(4-heptoxyphenyl)nicotinonitrile Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O3/c1-4-5-6-7-8-15-33-21-12-9-19(10-13-21)22-17-24(30-27(29)23(22)18-28)20-11-14-25(31-2)26(16-20)32-3/h9-14,16-17H,4-8,15H2,1-3H3,(H2,29,30)