(E)-2-cyano-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-isopentyloxy-3-methoxy-phenyl)-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-isoamoxy-3-methoxy-phenyl)-N-(3-pyridylmethyl)acrylamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NCC2=CN=CC=C2)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CN=CC=C2)OC

InChI

InChI=1S/C22H25N3O3/c1-16(2)8-10-28-20-7-6-17(12-21(20)27-3)11-19(13-23)22(26)25-15-18-5-4-9-24-14-18/h4-7,9,11-12,14,16H,8,10,15H2,1-3H3,(H,25,26)/b19-11+