(Z)-3-[(3-acetamido-4-methoxy-phenyl)amino]-2-cyano-prop-2-enoic acid

Systemtic Name: (Z)-3-[(3-acetamido-4-methoxy-phenyl)amino]-2-cyano-prop-2-enoic acid Openeye Name: (Z)-3-(3-acetamido-4-methoxy-anilino)-2-cyano-prop-2-enoic acid CAS Name: (Z)-3-(3-acetamido-4-methoxyanilino)-2-cyano-2-propenoic acid IUPAC Name: (Z)-3-(3-acetamido-4-methoxyanilino)-2-cyanoprop-2-enoic acid Traditional Name: (Z)-3-(3-acetamido-4-methoxy-anilino)-2-cyano-acrylic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4/c1-8(17)16-11-5-10(3-4-12(11)20-2)15-7-9(6-14)13(18)19/h3-5,7,15H,1-2H3,(H,16,17)(H,18,19)/b9-7-