[2-(tert-butylamino)-2-oxidanylidene-ethyl]-[[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[[(4S)-5-carbethoxy-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-ammonium Formula: C17H31N4O4+ MolecularWeight: 355.45244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)C[NH+](C)CC(=O)NC(C)(C)C)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)C[NH+](C)CC(=O)NC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C17H30N4O4/c1-7-11-14(15(23)25-8-2)12(19-16(24)18-11)9-21(6)10-13(22)20-17(3,4)5/h11H,7-10H2,1-6H3,(H,20,22)(H2,18,19,24)/p+1/t11-/m0/s1