2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 2-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 2-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 2-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 2-[[(E)-3-coumaran-5-ylacryloyl]amino]butyric acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C=CC1=CC2=C(C=C1)OCC2

Isomeric SMILES

CCC(C(=O)O)NC(=O)/C=C/C1=CC2=C(C=C1)OCC2

InChI

InChI=1S/C15H17NO4/c1-2-12(15(18)19)16-14(17)6-4-10-3-5-13-11(9-10)7-8-20-13/h3-6,9,12H,2,7-8H2,1H3,(H,16,17)(H,18,19)/b6-4+