dimethyl-[2-[4-[[(2R)-1-oxidanylbutan-2-yl]amino]quinazolin-2-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-[[(2R)-1-oxidanylbutan-2-yl]amino]quinazolin-2-yl]ethyl]azanium Openeye Name: 2-[4-[[(1R)-1-(hydroxymethyl)propyl]amino]quinazolin-2-yl]ethyl-dimethyl-ammonium CAS Name: 2-[4-[[(2R)-1-hydroxybutan-2-yl]amino]-2-quinazolinyl]ethyl-dimethylammonium IUPAC Name: 2-[4-[[(2R)-1-hydroxybutan-2-yl]amino]quinazolin-2-yl]ethyl-dimethylazanium Traditional Name: dimethyl-[2-[4-[[(1R)-1-methylolpropyl]amino]quinazolin-2-yl]ethyl]ammonium Formula: C16H25N4O+ MolecularWeight: 289.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

Isomeric SMILES

CC[C@H](CO)NC1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

InChI

InChI=1S/C16H24N4O/c1-4-12(11-21)17-16-13-7-5-6-8-14(13)18-15(19-16)9-10-20(2)3/h5-8,12,21H,4,9-11H2,1-3H3,(H,17,18,19)/p+1/t12-/m1/s1