[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]-methyl-ammonium Formula: C17H25N4O2+ MolecularWeight: 317.406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC(=O)NC(C)(C)C

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C17H24N4O2/c1-11(21(5)10-14(22)20-17(2,3)4)15-18-13-9-7-6-8-12(13)16(23)19-15/h6-9,11H,10H2,1-5H3,(H,20,22)(H,18,19,23)/p+1/t11-/m1/s1