methyl 3-[2-[1-methyl-2-(2-piperidin-4-ylethyl)imidazol-4-yl]phenyl]propanoate dihydrochloride

Systemtic Name: methyl 3-[2-[1-methyl-2-(2-piperidin-4-ylethyl)imidazol-4-yl]phenyl]propanoate dihydrochloride Openeye Name: methyl 3-[2-[1-methyl-2-[2-(4-piperidyl)ethyl]imidazol-4-yl]phenyl]propanoate dihydrochloride CAS Name: 3-[2-[1-methyl-2-[2-(4-piperidinyl)ethyl]-4-imidazolyl]phenyl]propanoic acid methyl ester dihydrochloride IUPAC Name: methyl 3-[2-[1-methyl-2-(2-piperidin-4-ylethyl)imidazol-4-yl]phenyl]propanoate dihydrochloride Traditional Name: 3-[2-[1-methyl-2-[2-(4-piperidyl)ethyl]imidazol-4-yl]phenyl]propionic acid methyl ester dihydrochloride Formula: C21H31Cl2N3O2 MolecularWeight: 428.39574

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1CCC2CCNCC2)C3=CC=CC=C3CCC(=O)OC.Cl.Cl

Isomeric SMILES

CN1C=C(N=C1CCC2CCNCC2)C3=CC=CC=C3CCC(=O)OC.Cl.Cl

InChI

InChI=1S/C21H29N3O2.2ClH/c1-24-15-19(23-20(24)9-7-16-11-13-22-14-12-16)18-6-4-3-5-17(18)8-10-21(25)26-2;;/h3-6,15-16,22H,7-14H2,1-2H3;2*1H