[1-(2,5-dimethylpiperidin-1-yl)-3-methyl-but-2-enyl] (Z)-3-phenylprop-2-enoate hydrochloride

Systemtic Name: [1-(2,5-dimethylpiperidin-1-yl)-3-methyl-but-2-enyl] (Z)-3-phenylprop-2-enoate hydrochloride Openeye Name: [1-(2,5-dimethyl-1-piperidyl)-3-methyl-but-2-enyl] (Z)-3-phenylprop-2-enoate hydrochloride CAS Name: (Z)-3-phenyl-2-propenoic acid [1-(2,5-dimethyl-1-piperidinyl)-3-methylbut-2-enyl] ester hydrochloride IUPAC Name: [1-(2,5-dimethylpiperidin-1-yl)-3-methylbut-2-enyl] (Z)-3-phenylprop-2-enoate hydrochloride Traditional Name: (Z)-3-phenylacrylic acid [1-(2,5-dimethylpiperidino)-3-methyl-but-2-enyl] ester hydrochloride Formula: C21H30ClNO2 MolecularWeight: 363.9214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N(C1)C(C=C(C)C)OC(=O)C=CC2=CC=CC=C2)C.Cl

Isomeric SMILES

CC1CCC(N(C1)C(C=C(C)C)OC(=O)/C=C\C2=CC=CC=C2)C.Cl

InChI

InChI=1S/C21H29NO2.ClH/c1-16(2)14-20(22-15-17(3)10-11-18(22)4)24-21(23)13-12-19-8-6-5-7-9-19;/h5-9,12-14,17-18,20H,10-11,15H2,1-4H3;1H/b13-12-;