(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chloranylnaphthalen-1-yl)oxybutanoate

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chloranylnaphthalen-1-yl)oxybutanoate Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-[(4-chloro-1-naphthyl)oxy]butanoate CAS Name: 2-[(4-chloro-1-naphthalenyl)oxy]butanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chloronaphthalen-1-yl)oxybutanoate Traditional Name: 2-(4-chloro-1-naphthoxy)butyric acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Formula: C22H26ClNO3 MolecularWeight: 387.89974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CC2CCC(C1)N2C)OC3=CC=C(C4=CC=CC=C43)Cl

Isomeric SMILES

CCC(C(=O)OC1CC2CCC(C1)N2C)OC3=CC=C(C4=CC=CC=C43)Cl

InChI

InChI=1S/C22H26ClNO3/c1-3-20(22(25)26-16-12-14-8-9-15(13-16)24(14)2)27-21-11-10-19(23)17-6-4-5-7-18(17)21/h4-7,10-11,14-16,20H,3,8-9,12-13H2,1-2H3