methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-(2-thienylmethyl)ammonium CAS Name: methyl-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-methyl-(2-thenyl)ammonium Formula: C19H27N3OS+2 MolecularWeight: 345.50218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C19H25N3OS/c1-21(14-18-5-4-12-24-18)15-19(23)20-17-8-6-16(7-9-17)13-22-10-2-3-11-22/h4-9,12H,2-3,10-11,13-15H2,1H3,(H,20,23)/p+2