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

Systemtic Name: 4-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 4-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 4-[[(E)-3-(2,3-dihydrobenzofuran-5-yl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 4-[[(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 4-[[(E)-3-coumaran-5-ylacryloyl]amino]butyric acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C=CC(=O)NCCCC(=O)O

Isomeric SMILES

C1COC2=C1C=C(C=C2)/C=C/C(=O)NCCCC(=O)O

InChI

InChI=1S/C15H17NO4/c17-14(16-8-1-2-15(18)19)6-4-11-3-5-13-12(10-11)7-9-20-13/h3-6,10H,1-2,7-9H2,(H,16,17)(H,18,19)/b6-4+