4-[(4-phenylmethoxyphenyl)methyl-pyridin-3-yl-amino]benzenecarbonitrile

Systemtic Name: 4-[(4-phenylmethoxyphenyl)methyl-pyridin-3-yl-amino]benzenecarbonitrile Openeye Name: 4-[(4-benzyloxyphenyl)methyl-(3-pyridyl)amino]benzonitrile CAS Name: 4-[(4-phenylmethoxyphenyl)methyl-(3-pyridinyl)amino]benzonitrile IUPAC Name: 4-[(4-phenylmethoxyphenyl)methyl-pyridin-3-ylamino]benzonitrile Traditional Name: 4-[(4-benzoxybenzyl)-(3-pyridyl)amino]benzonitrile Formula: C26H21N3O MolecularWeight: 391.46444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN(C3=CC=C(C=C3)C#N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN(C3=CC=C(C=C3)C#N)C4=CN=CC=C4

InChI

InChI=1S/C26H21N3O/c27-17-21-8-12-24(13-9-21)29(25-7-4-16-28-18-25)19-22-10-14-26(15-11-22)30-20-23-5-2-1-3-6-23/h1-16,18H,19-20H2