N'-[2-[3,4-bis(phenylmethoxy)phenyl]ethyl]-N-cyano-pyridine-3-carboximidamide

Systemtic Name: N'-[2-[3,4-bis(phenylmethoxy)phenyl]ethyl]-N-cyano-pyridine-3-carboximidamide Openeye Name: N-cyano-N'-[2-(3,4-dibenzyloxyphenyl)ethyl]pyridine-3-carboxamidine CAS Name: N'-[2-[3,4-bis(phenylmethoxy)phenyl]ethyl]-N-cyano-3-pyridinecarboximidamide IUPAC Name: N'-[2-[3,4-bis(phenylmethoxy)phenyl]ethyl]-N-cyanopyridine-3-carboximidamide Traditional Name: N-cyano-N'-[2-(3,4-dibenzoxyphenyl)ethyl]nicotinamidine Formula: C29H26N4O2 MolecularWeight: 462.54234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCN=C(C3=CN=CC=C3)NC#N)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCN=C(C3=CN=CC=C3)NC#N)OCC4=CC=CC=C4

InChI

InChI=1S/C29H26N4O2/c30-22-33-29(26-12-7-16-31-19-26)32-17-15-23-13-14-27(34-20-24-8-3-1-4-9-24)28(18-23)35-21-25-10-5-2-6-11-25/h1-14,16,18-19H,15,17,20-21H2,(H,32,33)