4-(aminomethyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-benzoic acid

Systemtic Name: 4-(aminomethyl)-3-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-benzoic acid Openeye Name: 4-(aminomethyl)-3-(2-hydroxy-1-methyl-2-oxo-ethoxy)benzoic acid CAS Name: 4-(aminomethyl)-3-(1-hydroxy-1-oxopropan-2-yl)oxybenzoic acid IUPAC Name: 4-(aminomethyl)-3-(1-hydroxy-1-oxopropan-2-yl)oxybenzoic acid Traditional Name: 4-(aminomethyl)-3-(2-hydroxy-2-keto-1-methyl-ethoxy)benzoic acid Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=CC(=C1)C(=O)O)CN

Isomeric SMILES

CC(C(=O)O)OC1=C(C=CC(=C1)C(=O)O)CN

InChI

InChI=1S/C11H13NO5/c1-6(10(13)14)17-9-4-7(11(15)16)2-3-8(9)5-12/h2-4,6H,5,12H2,1H3,(H,13,14)(H,15,16)