[(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone

Systemtic Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone Openeye Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-isopropoxyphenyl)methanone CAS Name: [(3S)-1-cyclobutyl-3-piperidin-1-iumyl]-(3-propan-2-yloxyphenyl)methanone IUPAC Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-propan-2-yloxyphenyl)methanone Traditional Name: [(3S)-1-cyclobutylpiperidin-1-ium-3-yl]-(3-isopropoxyphenyl)methanone Formula: C19H28NO2+ MolecularWeight: 302.43112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2CCC[NH+](C2)C3CCC3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)[C@H]2CCC[NH+](C2)C3CCC3

InChI

InChI=1S/C19H27NO2/c1-14(2)22-18-10-3-6-15(12-18)19(21)16-7-5-11-20(13-16)17-8-4-9-17/h3,6,10,12,14,16-17H,4-5,7-9,11,13H2,1-2H3/p+1/t16-/m0/s1