(E)-3-(2-cyano-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-cyano-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid Openeye Name: (E)-3-(2-cyanochroman-6-yl)prop-2-enoic acid CAS Name: (E)-3-(2-cyano-3,4-dihydro-2H-1-benzopyran-6-yl)-2-propenoic acid IUPAC Name: (E)-3-(2-cyano-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid Traditional Name: (E)-3-(2-cyanochroman-6-yl)acrylic acid Formula: C13H11NO3 MolecularWeight: 229.23134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C=CC(=O)O)OC1C#N

Isomeric SMILES

C1CC2=C(C=CC(=C2)/C=C/C(=O)O)OC1C#N

InChI

InChI=1S/C13H11NO3/c14-8-11-4-3-10-7-9(2-6-13(15)16)1-5-12(10)17-11/h1-2,5-7,11H,3-4H2,(H,15,16)/b6-2+