benzenecarbonitrile; N-[(4-phenylmethoxyphenyl)methyl]pyridin-3-amine

Systemtic Name: benzenecarbonitrile; N-[(4-phenylmethoxyphenyl)methyl]pyridin-3-amine Openeye Name: benzonitrile; N-[(4-benzyloxyphenyl)methyl]pyridin-3-amine CAS Name: benzonitrile; N-[(4-phenylmethoxyphenyl)methyl]-3-pyridinamine IUPAC Name: benzonitrile; N-[(4-phenylmethoxyphenyl)methyl]pyridin-3-amine Traditional Name: benzonitrile; (4-benzoxybenzyl)-(3-pyridyl)amine Formula: C26H23N3O MolecularWeight: 393.48032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CNC3=CN=CC=C3.C1=CC=C(C=C1)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CNC3=CN=CC=C3.C1=CC=C(C=C1)C#N

InChI

InChI=1S/C19H18N2O.C7H5N/c1-2-5-17(6-3-1)15-22-19-10-8-16(9-11-19)13-21-18-7-4-12-20-14-18;8-6-7-4-2-1-3-5-7/h1-12,14,21H,13,15H2;1-5H