[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)prop-2-enoate hydrochloride

Systemtic Name: [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)prop-2-enoate hydrochloride Openeye Name: [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)prop-2-enoate hydrochloride CAS Name: (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)-2-propenoic acid [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester hydrochloride IUPAC Name: [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)prop-2-enoate hydrochloride Traditional Name: (E)-3-(4-chlorophenyl)-2-(4-methoxyphenyl)acrylic acid [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester hydrochloride Formula: C24H27Cl2NO3 MolecularWeight: 448.38208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(C2)OC(=O)C(=CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC.Cl

Isomeric SMILES

CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)/C(=C/C3=CC=C(C=C3)Cl)/C4=CC=C(C=C4)OC.Cl

InChI

InChI=1S/C24H26ClNO3.ClH/c1-26-19-9-10-20(26)15-22(14-19)29-24(27)23(13-16-3-7-18(25)8-4-16)17-5-11-21(28-2)12-6-17;/h3-8,11-13,19-20,22H,9-10,14-15H2,1-2H3;1H/b23-13+;/t19-,20+,22?;