[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl]-ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: [2-(1-azocanyl)-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl]-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: [2-(azocan-1-yl)-2-keto-ethyl]-ethyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C18H30N3O2S+ MolecularWeight: 352.5147

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)N2CCCCCCC2

Isomeric SMILES

CC[NH+](CC(=O)NCC1=CC=CS1)CC(=O)N2CCCCCCC2

InChI

InChI=1S/C18H29N3O2S/c1-2-20(14-17(22)19-13-16-9-8-12-24-16)15-18(23)21-10-6-4-3-5-7-11-21/h8-9,12H,2-7,10-11,13-15H2,1H3,(H,19,22)/p+1