methyl-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-[[4-(methylcarbamoyl)phenyl]methyl]azanium

Systemtic Name: methyl-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-[[4-(methylcarbamoyl)phenyl]methyl]azanium Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl]-methyl-[[4-(methylcarbamoyl)phenyl]methyl]ammonium CAS Name: methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-[[4-(methylcarbamoyl)phenyl]methyl]ammonium IUPAC Name: methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]-[[4-(methylcarbamoyl)phenyl]methyl]azanium Traditional Name: [2-(tert-amylamino)-2-keto-ethyl]-methyl-[4-(methylcarbamoyl)benzyl]ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C[NH+](C)CC1=CC=C(C=C1)C(=O)NC

Isomeric SMILES

CCC(C)(C)NC(=O)C[NH+](C)CC1=CC=C(C=C1)C(=O)NC

InChI

InChI=1S/C17H27N3O2/c1-6-17(2,3)19-15(21)12-20(5)11-13-7-9-14(10-8-13)16(22)18-4/h7-10H,6,11-12H2,1-5H3,(H,18,22)(H,19,21)/p+1