3-(oxan-4-ylcarbonylamino)benzoic acid

Systemtic Name: 3-(oxan-4-ylcarbonylamino)benzoic acid Openeye Name: 3-(tetrahydropyran-4-carbonylamino)benzoic acid CAS Name: 3-[[4-oxanyl(oxo)methyl]amino]benzoic acid IUPAC Name: 3-(oxane-4-carbonylamino)benzoic acid Traditional Name: 3-(tetrahydropyran-4-carbonylamino)benzoic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1COCCC1C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C13H15NO4/c15-12(9-4-6-18-7-5-9)14-11-3-1-2-10(8-11)13(16)17/h1-3,8-9H,4-7H2,(H,14,15)(H,16,17)