2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]acetamide Formula: C22H31N2O3S+ MolecularWeight: 403.55814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NCC(C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC[C@H](C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C22H30N2O3S/c1-16(2)18-7-6-17(3)13-20(18)27-15-22(25)23-14-19(21-5-4-12-28-21)24-8-10-26-11-9-24/h4-7,12-13,16,19H,8-11,14-15H2,1-3H3,(H,23,25)/p+1/t19-/m1/s1