2-azanyl-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(4-hexoxyphenyl)-5-(2-methoxyphenyl)-6-methyl-nicotinonitrile Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C3=CC=CC=C3OC)C)N)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C3=CC=CC=C3OC)C)N)C#N

InChI

InChI=1S/C26H29N3O2/c1-4-5-6-9-16-31-20-14-12-19(13-15-20)25-22(17-27)26(28)29-18(2)24(25)21-10-7-8-11-23(21)30-3/h7-8,10-15H,4-6,9,16H2,1-3H3,(H2,28,29)