butyl-dimethyl-[3-[(2-methyl-1-sulfo-propan-2-yl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: butyl-dimethyl-[3-[(2-methyl-1-sulfo-propan-2-yl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: butyl-[3-[(1,1-dimethyl-2-sulfo-ethyl)amino]-3-oxo-propyl]-dimethyl-ammonium CAS Name: butyl-dimethyl-[3-[(2-methyl-1-sulfopropan-2-yl)amino]-3-oxopropyl]ammonium IUPAC Name: butyl-dimethyl-[3-[(2-methyl-1-sulfopropan-2-yl)amino]-3-oxopropyl]azanium Traditional Name: butyl-[3-[(1,1-dimethyl-2-sulfo-ethyl)amino]-3-keto-propyl]-dimethyl-ammonium Formula: C13H29N2O4S+ MolecularWeight: 309.44536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(C)CCC(=O)NC(C)(C)CS(=O)(=O)O

Isomeric SMILES

CCCC[N+](C)(C)CCC(=O)NC(C)(C)CS(=O)(=O)O

InChI

InChI=1S/C13H28N2O4S/c1-6-7-9-15(4,5)10-8-12(16)14-13(2,3)11-20(17,18)19/h6-11H2,1-5H3,(H-,14,16,17,18,19)/p+1