(3,3-dimethyl-2-oxidanylidene-butyl) 2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoate CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazinyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[4-(2-hydroxyethyl)piperazin-1-yl]benzoate Traditional Name: 2-[4-(2-hydroxyethyl)piperazino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1N2CCN(CC2)CCO

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1N2CCN(CC2)CCO

InChI

InChI=1S/C19H28N2O4/c1-19(2,3)17(23)14-25-18(24)15-6-4-5-7-16(15)21-10-8-20(9-11-21)12-13-22/h4-7,22H,8-14H2,1-3H3