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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O2S/c1-19(2)9-8-18-12-14-6-7-16(17(11-14)20-3)21-13-15-5-4-10-22-15/h4-7,10-11,18H,8-9,12-13H2,1-3H3/p+2