3-chloranyl-5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-4-methoxy-benzoic acid

Systemtic Name: 3-chloranyl-5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-4-methoxy-benzoic acid Openeye Name: 3-chloro-5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-4-methoxy-benzoic acid CAS Name: 3-chloro-5-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-4-methoxybenzoic acid IUPAC Name: 3-chloro-5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-4-methoxybenzoic acid Traditional Name: 3-chloro-5-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-4-methoxy-benzoic acid Formula: C17H14ClNO6 MolecularWeight: 363.74916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)O)NC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)O)NC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H14ClNO6/c1-23-15-11(18)6-10(17(21)22)7-12(15)19-16(20)9-2-3-13-14(8-9)25-5-4-24-13/h2-3,6-8H,4-5H2,1H3,(H,19,20)(H,21,22)