2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl]carbonylamino]benzoic acid Openeye Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]benzoic acid CAS Name: 2-[[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]benzoic acid Traditional Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carbonyl]amino]benzoic acid Formula: C20H15NO5S MolecularWeight: 381.4018

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CC=C(S3)C(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CC=C(S3)C(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C20H15NO5S/c22-19(21-14-4-2-1-3-13(14)20(23)24)18-8-7-17(27-18)12-5-6-15-16(11-12)26-10-9-25-15/h1-8,11H,9-10H2,(H,21,22)(H,23,24)