2-[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]benzoic acid Openeye Name: 2-[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]benzoic acid CAS Name: 2-[[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]benzoic acid Traditional Name: 2-[[(2S,3S)-2-methyl-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]benzoic acid Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C[C@H]1[C@H](OC2=CC=CC=C2O1)C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H15NO5/c1-10-15(23-14-9-5-4-8-13(14)22-10)16(19)18-12-7-3-2-6-11(12)17(20)21/h2-10,15H,1H3,(H,18,19)(H,20,21)/t10-,15-/m0/s1