N-[4-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[(E)-2-cyano-3-ethoxy-3-oxidanyl-prop-2-enoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[(E)-2-cyano-3-ethoxy-3-hydroxy-prop-2-enoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[(E)-2-cyano-3-ethoxy-3-hydroxy-1-oxoprop-2-enyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[(E)-2-cyano-3-ethoxy-3-hydroxyprop-2-enoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[(E)-2-cyano-3-ethoxy-3-hydroxy-acryloyl]phenyl]-2-methyl-benzamide Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C)O

Isomeric SMILES

CCO/C(=C(\C#N)/C(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C)/O

InChI

InChI=1S/C20H18N2O4/c1-3-26-20(25)17(12-21)18(23)14-8-10-15(11-9-14)22-19(24)16-7-5-4-6-13(16)2/h4-11,25H,3H2,1-2H3,(H,22,24)/b20-17+