[3-ethoxy-2-(thiophen-2-ylmethoxy)phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [3-ethoxy-2-(thiophen-2-ylmethoxy)phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [3-ethoxy-2-(2-thienylmethoxy)phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [3-ethoxy-2-(thiophen-2-ylmethoxy)phenyl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [3-ethoxy-2-(thiophen-2-ylmethoxy)phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [3-ethoxy-2-(2-thenyloxy)benzyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C21H32N2O3S+2 MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=CS2)C[NH2+]CCC[NH+]3CCOCC3

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=CS2)C[NH2+]CCC[NH+]3CCOCC3

InChI

InChI=1S/C21H30N2O3S/c1-2-25-20-8-3-6-18(21(20)26-17-19-7-4-15-27-19)16-22-9-5-10-23-11-13-24-14-12-23/h3-4,6-8,15,22H,2,5,9-14,16-17H2,1H3/p+2