[(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(3-butoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(C[NH3+])[NH+]2CCCC(C2)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)[C@H](C[NH3+])[NH+]2CCC[C@H](C2)C

InChI

InChI=1S/C18H30N2O/c1-3-4-11-21-17-9-5-8-16(12-17)18(13-19)20-10-6-7-15(2)14-20/h5,8-9,12,15,18H,3-4,6-7,10-11,13-14,19H2,1-2H3/p+2/t15-,18+/m1/s1