4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-2-oxidanyl-benzoic acid

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-2-oxidanyl-benzoic acid Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-2-hydroxy-benzoic acid CAS Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-2-hydroxybenzoic acid IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-2-hydroxybenzoic acid Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)-2-hydroxy-benzoic acid Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C(=O)O)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C(=O)O)O)OC1

InChI

InChI=1S/C17H15NO6/c19-13-9-11(3-4-12(13)17(21)22)18-16(20)10-2-5-14-15(8-10)24-7-1-6-23-14/h2-5,8-9,19H,1,6-7H2,(H,18,20)(H,21,22)