2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C20H26ClN2O3+ MolecularWeight: 377.88504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC[C@H](C2=CC=CO2)[NH+]3CCCCC3)Cl

InChI

InChI=1S/C20H25ClN2O3/c1-15-12-16(7-8-17(15)21)26-14-20(24)22-13-18(19-6-5-11-25-19)23-9-3-2-4-10-23/h5-8,11-12,18H,2-4,9-10,13-14H2,1H3,(H,22,24)/p+1/t18-/m1/s1