4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethylpiperidin-1-yl)-1-phenyl-ethanol

Systemtic Name: 4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethylpiperidin-1-yl)-1-phenyl-ethanol Openeye Name: 4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethyl-1-piperidyl)-1-phenyl-ethanol CAS Name: 4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethyl-1-piperidinyl)-1-phenylethanol IUPAC Name: 4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethylpiperidin-1-yl)-1-phenylethanol Traditional Name: 4-tert-butylbenzoic acid; 2-(2,2,4,6,6-pentamethylpiperidino)-1-phenyl-ethanol Formula: C29H43NO3 MolecularWeight: 453.65662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C(C1)(C)C)CC(C2=CC=CC=C2)O)(C)C.CC(C)(C)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC1CC(N(C(C1)(C)C)CC(C2=CC=CC=C2)O)(C)C.CC(C)(C)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C18H29NO.C11H14O2/c1-14-11-17(2,3)19(18(4,5)12-14)13-16(20)15-9-7-6-8-10-15;1-11(2,3)9-6-4-8(5-7-9)10(12)13/h6-10,14,16,20H,11-13H2,1-5H3;4-7H,1-3H3,(H,12,13)