2-cyano-3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: 2-cyano-3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-2-cyano-3-[3-ethoxy-4-(p-tolylmethoxy)phenyl]prop-2-enamide CAS Name: 2-cyano-3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-2-cyano-3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]prop-2-enamide Traditional Name: N-benzyl-2-cyano-3-[3-ethoxy-4-(4-methylbenzyl)oxy-phenyl]acrylamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C27H26N2O3/c1-3-31-26-16-23(13-14-25(26)32-19-22-11-9-20(2)10-12-22)15-24(17-28)27(30)29-18-21-7-5-4-6-8-21/h4-16H,3,18-19H2,1-2H3,(H,29,30)