2-(oxan-4-ylmethylamino)benzoic acid

Systemtic Name: 2-(oxan-4-ylmethylamino)benzoic acid Openeye Name: 2-(tetrahydropyran-4-ylmethylamino)benzoic acid CAS Name: 2-(4-oxanylmethylamino)benzoic acid IUPAC Name: 2-(oxan-4-ylmethylamino)benzoic acid Traditional Name: 2-(tetrahydropyran-4-ylmethylamino)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CNC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1COCCC1CNC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H17NO3/c15-13(16)11-3-1-2-4-12(11)14-9-10-5-7-17-8-6-10/h1-4,10,14H,5-9H2,(H,15,16)