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

Systemtic Name: 3-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylammonio]propyl-dimethylammonium IUPAC Name: 3-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[[3-methoxy-4-(2-thenyloxy)benzyl]ammonio]propyl-dimethyl-ammonium Formula: C18H28N2O2S+2 MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O2S/c1-20(2)10-5-9-19-13-15-7-8-17(18(12-15)21-3)22-14-16-6-4-11-23-16/h4,6-8,11-12,19H,5,9-10,13-14H2,1-3H3/p+2