N-[(E)-1-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]propylideneamino]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[(E)-1-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]propylideneamino]-2-thiophen-2-yl-ethanamide Openeye Name: N-[(E)-1-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]propylideneamino]-2-(2-thienyl)acetamide CAS Name: N-[(E)-1-[4-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]propylideneamino]-2-thiophen-2-ylacetamide IUPAC Name: N-[(E)-1-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]propylideneamino]-2-thiophen-2-ylacetamide Traditional Name: N-[(E)-1-[4-(2-morpholin-4-ium-4-ylethoxy)phenyl]propylideneamino]-2-(2-thienyl)acetamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)CC1=CC=CS1)C2=CC=C(C=C2)OCC[NH+]3CCOCC3

Isomeric SMILES

CC/C(=N\NC(=O)CC1=CC=CS1)/C2=CC=C(C=C2)OCC[NH+]3CCOCC3

InChI

InChI=1S/C21H27N3O3S/c1-2-20(22-23-21(25)16-19-4-3-15-28-19)17-5-7-18(8-6-17)27-14-11-24-9-12-26-13-10-24/h3-8,15H,2,9-14,16H2,1H3,(H,23,25)/p+1/b22-20+