ethyl 6-methyl-5-(phenylmethyl)-2-propan-2-yl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate hydrochloride

Systemtic Name: ethyl 6-methyl-5-(phenylmethyl)-2-propan-2-yl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate hydrochloride Openeye Name: ethyl 5-benzyl-2-isopropyl-6-methyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate hydrochloride CAS Name: 6-methyl-5-(phenylmethyl)-2-propan-2-yl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-benzyl-6-methyl-2-propan-2-yl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate hydrochloride Traditional Name: 5-benzyl-2-isopropyl-6-methyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid ethyl ester hydrochloride Formula: C21H30ClNO2 MolecularWeight: 363.9214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2C(N(C1C=C2C(C)C)CC3=CC=CC=C3)C.Cl

Isomeric SMILES

CCOC(=O)C1CC2C(N(C1C=C2C(C)C)CC3=CC=CC=C3)C.Cl

InChI

InChI=1S/C21H29NO2.ClH/c1-5-24-21(23)19-11-18-15(4)22(13-16-9-7-6-8-10-16)20(19)12-17(18)14(2)3;/h6-10,12,14-15,18-20H,5,11,13H2,1-4H3;1H