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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(C[NH3+])[NH+]2CCCCC2C

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O/c1-3-12-20-17-10-5-4-9-15(17)16(13-18)19-11-7-6-8-14(19)2/h4-5,9-10,14,16H,3,6-8,11-13,18H2,1-2H3/p+2/t14-,16-/m0/s1