2-[4-(1-benzothiophen-3-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-ethyl-ethanamide

Systemtic Name: 2-[4-(1-benzothiophen-3-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-ethyl-ethanamide Openeye Name: 2-[4-(benzothiophen-3-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-ethyl-acetamide CAS Name: 2-[4-(1-benzothiophen-3-yl)-2-(4-morpholin-4-iumylmethyl)phenoxy]-N-ethylacetamide IUPAC Name: 2-[4-(1-benzothiophen-3-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-ethylacetamide Traditional Name: 2-[4-(benzothiophen-3-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]-N-ethyl-acetamide Formula: C23H27N2O3S+ MolecularWeight: 411.53708

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC1=C(C=C(C=C1)C2=CSC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

CCNC(=O)COC1=C(C=C(C=C1)C2=CSC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C23H26N2O3S/c1-2-24-23(26)15-28-21-8-7-17(13-18(21)14-25-9-11-27-12-10-25)20-16-29-22-6-4-3-5-19(20)22/h3-8,13,16H,2,9-12,14-15H2,1H3,(H,24,26)/p+1