2-(4-chloranylphenoxy)-2-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]propionamide Formula: C20H26ClN2O3S+ MolecularWeight: 409.95004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCC(C1=CC=CS1)[NH+]2CCOCC2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NC[C@@H](C1=CC=CS1)[NH+]2CCOCC2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN2O3S/c1-20(2,26-16-7-5-15(21)6-8-16)19(24)22-14-17(18-4-3-13-27-18)23-9-11-25-12-10-23/h3-8,13,17H,9-12,14H2,1-2H3,(H,22,24)/p+1/t17-/m0/s1