2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC[C@H](C2=CC=C(C=C2)OC)[NH+]3CCCCC3)C

InChI

InChI=1S/C24H32N2O3/c1-18-13-19(2)15-22(14-18)29-17-24(27)25-16-23(26-11-5-4-6-12-26)20-7-9-21(28-3)10-8-20/h7-10,13-15,23H,4-6,11-12,16-17H2,1-3H3,(H,25,27)/p+1/t23-/m1/s1