[3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate hydrochloride

Systemtic Name: [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate hydrochloride Openeye Name: [3-(1H-imidazol-5-ylmethyl)indan-5-yl] 2,2-dimethylpropanoate hydrochloride CAS Name: 2,2-dimethylpropanoic acid [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] ester hydrochloride IUPAC Name: [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate hydrochloride Traditional Name: 2,2-dimethylpropionic acid [3-(1H-imidazol-5-ylmethyl)indan-5-yl] ester hydrochloride Formula: C18H23ClN2O2 MolecularWeight: 334.84042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC2=C(CCC2CC3=CN=CN3)C=C1.Cl

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC2=C(CCC2CC3=CN=CN3)C=C1.Cl

InChI

InChI=1S/C18H22N2O2.ClH/c1-18(2,3)17(21)22-15-7-6-12-4-5-13(16(12)9-15)8-14-10-19-11-20-14;/h6-7,9-11,13H,4-5,8H2,1-3H3,(H,19,20);1H