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

Systemtic Name: ethyl 4-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[2-hydroxy-3-(4-propionylphenoxy)propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C19H29ClN2O5 MolecularWeight: 400.89696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)OCC)O.Cl

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)OCC)O.Cl

InChI

InChI=1S/C19H28N2O5.ClH/c1-3-18(23)15-5-7-17(8-6-15)26-14-16(22)13-20-9-11-21(12-10-20)19(24)25-4-2;/h5-8,16,22H,3-4,9-14H2,1-2H3;1H