(E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)acrylamide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC3=C(C(=C2)OC)OCCO3)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)OC)OCCO3)/C#N

InChI

InChI=1S/C21H19N3O5/c1-13(25)23-16-3-5-17(6-4-16)24-21(26)15(12-22)9-14-10-18(27-2)20-19(11-14)28-7-8-29-20/h3-6,9-11H,7-8H2,1-2H3,(H,23,25)(H,24,26)/b15-9+