5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-methyl-2-oxidanyl-benzoate

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-methyl-2-oxidanyl-benzoate Openeye Name: 5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-2-hydroxy-3-methyl-benzoate CAS Name: 5-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-2-hydroxy-3-methylbenzoate IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-2-hydroxy-3-methylbenzoate Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-2-hydroxy-3-methyl-benzoate Formula: C17H14NO6- MolecularWeight: 328.29616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)[O-])O

Isomeric SMILES

CC1=C(C(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)[O-])O

InChI

InChI=1S/C17H15NO6/c1-9-6-11(8-12(15(9)19)17(21)22)18-16(20)10-2-3-13-14(7-10)24-5-4-23-13/h2-3,6-8,19H,4-5H2,1H3,(H,18,20)(H,21,22)/p-1