3-[5-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoic acid

Systemtic Name: 3-[5-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoic acid Openeye Name: 3-[5-[(E)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]-2-furyl]benzoic acid CAS Name: 3-[5-[(E)-2-cyano-3-(4-morpholinyl)-3-oxoprop-1-enyl]-2-furanyl]benzoic acid IUPAC Name: 3-[5-[(E)-2-cyano-3-morpholin-4-yl-3-oxoprop-1-enyl]furan-2-yl]benzoic acid Traditional Name: 3-[5-[(E)-2-cyano-3-keto-3-morpholino-prop-1-enyl]-2-furyl]benzoic acid Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)O)C#N

Isomeric SMILES

C1COCCN1C(=O)/C(=C/C2=CC=C(O2)C3=CC(=CC=C3)C(=O)O)/C#N

InChI

InChI=1S/C19H16N2O5/c20-12-15(18(22)21-6-8-25-9-7-21)11-16-4-5-17(26-16)13-2-1-3-14(10-13)19(23)24/h1-5,10-11H,6-9H2,(H,23,24)/b15-11+