4-[2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]benzoic acid

Systemtic Name: 4-[2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]benzoic acid Openeye Name: 4-[2-[[(E)-3-(2-furyl)prop-2-enoyl]amino]ethyl]benzoic acid CAS Name: 4-[2-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]benzoic acid Traditional Name: 4-[2-[[(E)-3-(2-furyl)acryloyl]amino]ethyl]benzoic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=COC(=C1)/C=C/C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H15NO4/c18-15(8-7-14-2-1-11-21-14)17-10-9-12-3-5-13(6-4-12)16(19)20/h1-8,11H,9-10H2,(H,17,18)(H,19,20)/b8-7+