(3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone hydrochloride

Systemtic Name: (3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone hydrochloride Openeye Name: (3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone hydrochloride CAS Name: (3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone hydrochloride Traditional Name: (3,5-ditert-butylphenyl)-[4-(2-hydroxyethyl)piperazino]methanone hydrochloride Formula: C21H35ClN2O2 MolecularWeight: 382.9678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)CCO)C(C)(C)C.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)CCO)C(C)(C)C.Cl

InChI

InChI=1S/C21H34N2O2.ClH/c1-20(2,3)17-13-16(14-18(15-17)21(4,5)6)19(25)23-9-7-22(8-10-23)11-12-24;/h13-15,24H,7-12H2,1-6H3;1H