4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine

Systemtic Name: 4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine Openeye Name: 4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine CAS Name: 4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine IUPAC Name: 4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine Traditional Name: 4-tert-butylbenzoic acid; 2,2,4,6,6-pentamethylpiperidine Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(C1)(C)C)(C)C.CC(C)(C)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC1CC(NC(C1)(C)C)(C)C.CC(C)(C)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H14O2.C10H21N/c1-11(2,3)9-6-4-8(5-7-9)10(12)13;1-8-6-9(2,3)11-10(4,5)7-8/h4-7H,1-3H3,(H,12,13);8,11H,6-7H2,1-5H3