methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-(thiophen-3-ylmethyl)azanium Traditional Name: [2-keto-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-methyl-(3-thenyl)ammonium Formula: C19H27N3OS+2 MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

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