(E)-2-cyano-3-(2,4-diacetamidophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(2,4-diacetamidophenyl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(2,4-diacetamidophenyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(2,4-diacetamidophenyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(2,4-diacetamidophenyl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(2,4-diacetamidophenyl)acrylic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C=C(C#N)C(=O)O)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)/C=C(\C#N)/C(=O)O)NC(=O)C

InChI

InChI=1S/C14H13N3O4/c1-8(18)16-12-4-3-10(5-11(7-15)14(20)21)13(6-12)17-9(2)19/h3-6H,1-2H3,(H,16,18)(H,17,19)(H,20,21)/b11-5+