(E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(2,4,6-trimethylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-mesityl-3-(7-methoxy-1,3-benzodioxol-5-yl)acrylamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(=CC2=CC3=C(C(=C2)OC)OCO3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)/C(=C/C2=CC3=C(C(=C2)OC)OCO3)/C#N)C

InChI

InChI=1S/C21H20N2O4/c1-12-5-13(2)19(14(3)6-12)23-21(24)16(10-22)7-15-8-17(25-4)20-18(9-15)26-11-27-20/h5-9H,11H2,1-4H3,(H,23,24)/b16-7+