3-[(Z)-[6-(2-morpholin-4-ylethoxy)-3-oxidanylidene-1-benzofuran-2-ylidene]methyl]benzoic acid

Systemtic Name: 3-[(Z)-[6-(2-morpholin-4-ylethoxy)-3-oxidanylidene-1-benzofuran-2-ylidene]methyl]benzoic acid Openeye Name: 3-[(Z)-[6-(2-morpholinoethoxy)-3-oxo-benzofuran-2-ylidene]methyl]benzoic acid CAS Name: 3-[(Z)-[6-[2-(4-morpholinyl)ethoxy]-3-oxo-2-benzofuranylidene]methyl]benzoic acid IUPAC Name: 3-[(Z)-[6-(2-morpholin-4-ylethoxy)-3-oxo-1-benzofuran-2-ylidene]methyl]benzoic acid Traditional Name: 3-[(Z)-[3-keto-6-(2-morpholinoethoxy)coumaran-2-ylidene]methyl]benzoic acid Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)C(=O)O)O3

Isomeric SMILES

C1COCCN1CCOC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC(=CC=C4)C(=O)O)/O3

InChI

InChI=1S/C22H21NO6/c24-21-18-5-4-17(28-11-8-23-6-9-27-10-7-23)14-19(18)29-20(21)13-15-2-1-3-16(12-15)22(25)26/h1-5,12-14H,6-11H2,(H,25,26)/b20-13-