5-azanyl-2-oxidanyl-benzoic acid; 4-(4-azanyl-3,3,5,5-tetramethyl-cyclohexyl)aniline

Systemtic Name: 5-azanyl-2-oxidanyl-benzoic acid; 4-(4-azanyl-3,3,5,5-tetramethyl-cyclohexyl)aniline Openeye Name: 5-amino-2-hydroxy-benzoic acid; 4-(4-amino-3,3,5,5-tetramethyl-cyclohexyl)aniline CAS Name: 5-amino-2-hydroxybenzoic acid; 4-(4-amino-3,3,5,5-tetramethylcyclohexyl)aniline IUPAC Name: 5-amino-2-hydroxybenzoic acid; 4-(4-amino-3,3,5,5-tetramethylcyclohexyl)aniline Traditional Name: 5-amino-2-hydroxy-benzoic acid; [4-(4-aminophenyl)-2,2,6,6-tetramethyl-cyclohexyl]amine Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1N)(C)C)C2=CC=C(C=C2)N)C.C1=CC(=C(C=C1N)C(=O)O)O

Isomeric SMILES

CC1(CC(CC(C1N)(C)C)C2=CC=C(C=C2)N)C.C1=CC(=C(C=C1N)C(=O)O)O

InChI

InChI=1S/C16H26N2.C7H7NO3/c1-15(2)9-12(10-16(3,4)14(15)18)11-5-7-13(17)8-6-11;8-4-1-2-6(9)5(3-4)7(10)11/h5-8,12,14H,9-10,17-18H2,1-4H3;1-3,9H,8H2,(H,10,11)