5-(3,4-dimethoxyphenyl)-4-[[3-(2-hydroxyethyloxy)phenyl]amino]pyridine-3-carbonitrile

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4-[[3-(2-hydroxyethyloxy)phenyl]amino]pyridine-3-carbonitrile Openeye Name: 5-(3,4-dimethoxyphenyl)-4-[3-(2-hydroxyethoxy)anilino]pyridine-3-carbonitrile CAS Name: 5-(3,4-dimethoxyphenyl)-4-[3-(2-hydroxyethoxy)anilino]-3-pyridinecarbonitrile IUPAC Name: 5-(3,4-dimethoxyphenyl)-4-[3-(2-hydroxyethoxy)anilino]pyridine-3-carbonitrile Traditional Name: 5-(3,4-dimethoxyphenyl)-4-[3-(2-hydroxyethoxy)anilino]nicotinonitrile Formula: C22H21N3O4 MolecularWeight: 391.41984

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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(=CC=C3)OCCO)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O4/c1-27-20-7-6-15(10-21(20)28-2)19-14-24-13-16(12-23)22(19)25-17-4-3-5-18(11-17)29-9-8-26/h3-7,10-11,13-14,26H,8-9H2,1-2H3,(H,24,25)