1-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[3-methoxy-4-(2-thienylmethoxy)phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[3-methoxy-4-(2-thenyloxy)benzylidene]-(4-methylpiperazin-4-ium-1-yl)amine Formula: C18H24N3O2S+ MolecularWeight: 346.46706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C=C2)OCC3=CC=CS3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C=C2)OCC3=CC=CS3)OC

InChI

InChI=1S/C18H23N3O2S/c1-20-7-9-21(10-8-20)19-13-15-5-6-17(18(12-15)22-2)23-14-16-4-3-11-24-16/h3-6,11-13H,7-10,14H2,1-2H3/p+1/b19-13-