3-methyl-4-(oxan-4-ylamino)benzoic acid

Systemtic Name: 3-methyl-4-(oxan-4-ylamino)benzoic acid Openeye Name: 3-methyl-4-(tetrahydropyran-4-ylamino)benzoic acid CAS Name: 3-methyl-4-(4-oxanylamino)benzoic acid IUPAC Name: 3-methyl-4-(oxan-4-ylamino)benzoic acid Traditional Name: 3-methyl-4-(tetrahydropyran-4-ylamino)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC2CCOCC2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC2CCOCC2

InChI

InChI=1S/C13H17NO3/c1-9-8-10(13(15)16)2-3-12(9)14-11-4-6-17-7-5-11/h2-3,8,11,14H,4-7H2,1H3,(H,15,16)