(2S)-1-[(2-chlorophenyl)methoxy]-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-[(2-chlorophenyl)methoxy]-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-[(2-chlorophenyl)methoxy]-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-[(2-chlorophenyl)methoxy]-3-[(2R)-2-ethyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-[(2-chlorophenyl)methoxy]-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-(2-chlorobenzyl)oxy-3-[(2R)-2-ethylpiperidin-1-ium-1-yl]propan-2-ol Formula: C17H27ClNO2+ MolecularWeight: 312.85478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(COCC2=CC=CC=C2Cl)O

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1C[C@@H](COCC2=CC=CC=C2Cl)O

InChI

InChI=1S/C17H26ClNO2/c1-2-15-8-5-6-10-19(15)11-16(20)13-21-12-14-7-3-4-9-17(14)18/h3-4,7,9,15-16,20H,2,5-6,8,10-13H2,1H3/p+1/t15-,16+/m1/s1