3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]benzenecarbonitrile

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]benzenecarbonitrile Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzonitrile CAS Name: 3-[3-cyclopentyloxy-4-methoxy-N-(3-pyridinylmethyl)anilino]benzonitrile IUPAC Name: 3-[3-cyclopentyloxy-4-methoxy-N-(pyridin-3-ylmethyl)anilino]benzonitrile Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzonitrile Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C#N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC=CC(=C3)C#N)OC4CCCC4

InChI

InChI=1S/C25H25N3O2/c1-29-24-12-11-22(15-25(24)30-23-9-2-3-10-23)28(18-20-7-5-13-27-17-20)21-8-4-6-19(14-21)16-26/h4-8,11-15,17,23H,2-3,9-10,18H2,1H3