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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4/c1-10(8-15(18)19)16-14(17)5-3-11-2-4-13-12(9-11)6-7-20-13/h2-5,9-10H,6-8H2,1H3,(H,16,17)(H,18,19)/b5-3+