[(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-propoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-propoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-propoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]-2-(4-propoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-propoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-2-(4-propoxyphenyl)ethyl]ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C[NH3+])[NH+]2CCCCC2C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H](C[NH3+])[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C17H28N2O/c1-3-12-20-16-9-7-15(8-10-16)17(13-18)19-11-5-4-6-14(19)2/h7-10,14,17H,3-6,11-13,18H2,1-2H3/p+2/t14-,17-/m0/s1