3-(aminomethyl)-5-tert-butyl-2-oxidanyl-benzoic acid chloride

Systemtic Name: 3-(aminomethyl)-5-tert-butyl-2-oxidanyl-benzoic acid chloride Openeye Name: 3-(aminomethyl)-5-tert-butyl-2-hydroxy-benzoic acid chloride CAS Name: 3-(aminomethyl)-5-tert-butyl-2-hydroxybenzoic acid chloride IUPAC Name: 3-(aminomethyl)-5-tert-butyl-2-hydroxybenzoic acid chloride Traditional Name: 3-(aminomethyl)-5-tert-butyl-2-hydroxy-benzoic acid chloride Formula: C12H17ClNO3- MolecularWeight: 258.72128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)CN.[Cl-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)CN.[Cl-]

InChI

InChI=1S/C12H17NO3.ClH/c1-12(2,3)8-4-7(6-13)10(14)9(5-8)11(15)16;/h4-5,14H,6,13H2,1-3H3,(H,15,16);1H/p-1