[(2R)-2-(2-butoxy-4-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(2-butoxy-4-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(2-butoxy-4-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(2-butoxy-4-methoxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(2-butoxy-4-methoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(2-butoxy-4-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C19H34N2O2+2 MolecularWeight: 322.48546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)OC)C(C[NH3+])[NH+]2CCCCC2C

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)OC)[C@H](C[NH3+])[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C19H32N2O2/c1-4-5-12-23-19-13-16(22-3)9-10-17(19)18(14-20)21-11-7-6-8-15(21)2/h9-10,13,15,18H,4-8,11-12,14,20H2,1-3H3/p+2/t15-,18-/m0/s1