5-(3,4-dimethoxyphenyl)-4-[(4-phenoxyphenyl)amino]pyridine-3-carbonitrile

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4-[(4-phenoxyphenyl)amino]pyridine-3-carbonitrile Openeye Name: 5-(3,4-dimethoxyphenyl)-4-(4-phenoxyanilino)pyridine-3-carbonitrile CAS Name: 5-(3,4-dimethoxyphenyl)-4-(4-phenoxyanilino)-3-pyridinecarbonitrile IUPAC Name: 5-(3,4-dimethoxyphenyl)-4-(4-phenoxyanilino)pyridine-3-carbonitrile Traditional Name: 5-(3,4-dimethoxyphenyl)-4-(4-phenoxyanilino)nicotinonitrile Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=CN=C2)C#N)NC3=CC=C(C=C3)OC4=CC=CC=C4)OC

InChI

InChI=1S/C26H21N3O3/c1-30-24-13-8-18(14-25(24)31-2)23-17-28-16-19(15-27)26(23)29-20-9-11-22(12-10-20)32-21-6-4-3-5-7-21/h3-14,16-17H,1-2H3,(H,28,29)