ethyl 4-[2-oxidanyl-3-(4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[2-oxidanyl-3-(4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[2-hydroxy-3-(4-isopropylphenoxy)propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[2-hydroxy-3-(4-propan-2-ylphenoxy)propyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[2-hydroxy-3-(4-propan-2-ylphenoxy)propyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[2-hydroxy-3-(4-isopropylphenoxy)propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C19H31ClN2O4 MolecularWeight: 386.91344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(COC2=CC=C(C=C2)C(C)C)O.Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(COC2=CC=C(C=C2)C(C)C)O.Cl

InChI

InChI=1S/C19H30N2O4.ClH/c1-4-24-19(23)21-11-9-20(10-12-21)13-17(22)14-25-18-7-5-16(6-8-18)15(2)3;/h5-8,15,17,22H,4,9-14H2,1-3H3;1H