(phenylmethyl) 2-(piperidin-4-ylamino)but-3-enoate hydrochloride

Systemtic Name: (phenylmethyl) 2-(piperidin-4-ylamino)but-3-enoate hydrochloride Openeye Name: benzyl 2-(4-piperidylamino)but-3-enoate hydrochloride CAS Name: 2-(4-piperidinylamino)-3-butenoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-(piperidin-4-ylamino)but-3-enoate hydrochloride Traditional Name: 2-(4-piperidylamino)but-3-enoic acid benzyl ester hydrochloride Formula: C16H23ClN2O2 MolecularWeight: 310.81902

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(=O)OCC1=CC=CC=C1)NC2CCNCC2.Cl

Isomeric SMILES

C=CC(C(=O)OCC1=CC=CC=C1)NC2CCNCC2.Cl

InChI

InChI=1S/C16H22N2O2.ClH/c1-2-15(18-14-8-10-17-11-9-14)16(19)20-12-13-6-4-3-5-7-13;/h2-7,14-15,17-18H,1,8-12H2;1H