[(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium

Systemtic Name: [(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Openeye Name: [(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]ethyl]ammonium IUPAC Name: [(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]azanium Traditional Name: [(2R)-2-(3,4-diethoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C[NH3+])[NH+]2CCCCC2C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+]2CCCC[C@@H]2C)OCC

InChI

InChI=1S/C18H30N2O2/c1-4-21-17-10-9-15(12-18(17)22-5-2)16(13-19)20-11-7-6-8-14(20)3/h9-10,12,14,16H,4-8,11,13,19H2,1-3H3/p+2/t14-,16-/m0/s1