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

Systemtic Name: 2-azanyl-4-(4-heptoxyphenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-heptoxyphenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-heptoxyphenyl)-6-(4-phenoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(4-heptoxyphenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(4-heptoxyphenyl)-6-(4-phenoxyphenyl)nicotinonitrile Formula: C31H31N3O2 MolecularWeight: 477.59674

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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)OC4=CC=CC=C4

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C31H31N3O2/c1-2-3-4-5-9-20-35-25-16-12-23(13-17-25)28-21-30(34-31(33)29(28)22-32)24-14-18-27(19-15-24)36-26-10-7-6-8-11-26/h6-8,10-19,21H,2-5,9,20H2,1H3,(H2,33,34)