ethyl 3-(4-pyridin-2-ylpiperazin-1-yl)propanoate hydrate hydrochloride

Systemtic Name: ethyl 3-(4-pyridin-2-ylpiperazin-1-yl)propanoate hydrate hydrochloride Openeye Name: ethyl 3-[4-(2-pyridyl)piperazin-1-yl]propanoate hydrate hydrochloride CAS Name: 3-[4-(2-pyridinyl)-1-piperazinyl]propanoic acid ethyl ester hydrate hydrochloride IUPAC Name: ethyl 3-(4-pyridin-2-ylpiperazin-1-yl)propanoate hydrate hydrochloride Traditional Name: 3-[4-(2-pyridyl)piperazino]propionic acid ethyl ester hydrate hydrochloride Formula: C14H24ClN3O3 MolecularWeight: 317.81166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCN(CC1)C2=CC=CC=N2.O.Cl

Isomeric SMILES

CCOC(=O)CCN1CCN(CC1)C2=CC=CC=N2.O.Cl

InChI

InChI=1S/C14H21N3O2.ClH.H2O/c1-2-19-14(18)6-8-16-9-11-17(12-10-16)13-5-3-4-7-15-13;;/h3-5,7H,2,6,8-12H2,1H3;1H;1H2