[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]benzyl]-(2-thenyl)ammonium Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=CC=C(C=C1)C[NH2+]CC2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)COC1=CC=C(C=C1)C[NH2+]CC2=CC=CS2

InChI

InChI=1S/C18H24N2O2S/c1-18(2,3)20-17(21)13-22-15-8-6-14(7-9-15)11-19-12-16-5-4-10-23-16/h4-10,19H,11-13H2,1-3H3,(H,20,21)/p+1