4-tert-butylbenzoic acid; 2-piperidin-1-ylethanol; hydrochloride

Systemtic Name: 4-tert-butylbenzoic acid; 2-piperidin-1-ylethanol; hydrochloride Openeye Name: 4-tert-butylbenzoic acid; 2-(1-piperidyl)ethanol; hydrochloride CAS Name: 4-tert-butylbenzoic acid; 2-(1-piperidinyl)ethanol; hydrochloride IUPAC Name: 4-tert-butylbenzoic acid; 2-piperidin-1-ylethanol; hydrochloride Traditional Name: 4-tert-butylbenzoic acid; 2-piperidinoethanol; hydrochloride Formula: C18H30ClNO3 MolecularWeight: 343.8887

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)O.C1CCN(CC1)CCO.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)O.C1CCN(CC1)CCO.Cl

InChI

InChI=1S/C11H14O2.C7H15NO.ClH/c1-11(2,3)9-6-4-8(5-7-9)10(12)13;9-7-6-8-4-2-1-3-5-8;/h4-7H,1-3H3,(H,12,13);9H,1-7H2;1H