[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[3-(methylazaniumyl)propyl]azanium

Systemtic Name: [3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[3-(methylazaniumyl)propyl]azanium Openeye Name: [3-methoxy-4-(2-thienylmethoxy)phenyl]methyl-[3-(methylammonio)propyl]ammonium CAS Name: [3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[3-(methylammonio)propyl]ammonium IUPAC Name: [3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[3-(methylazaniumyl)propyl]azanium Traditional Name: [3-methoxy-4-(2-thenyloxy)benzyl]-[3-(methylammonio)propyl]ammonium Formula: C17H26N2O2S+2 MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CS2)OC

Isomeric SMILES

C[NH2+]CCC[NH2+]CC1=CC(=C(C=C1)OCC2=CC=CS2)OC

InChI

InChI=1S/C17H24N2O2S/c1-18-8-4-9-19-12-14-6-7-16(17(11-14)20-2)21-13-15-5-3-10-22-15/h3,5-7,10-11,18-19H,4,8-9,12-13H2,1-2H3/p+2