(2S)-1-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]propan-2-ol

Systemtic Name: (2S)-1-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]propan-2-ol Openeye Name: (2S)-1-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]propan-2-ol CAS Name: (2S)-1-[[2-(1-pyrrolidin-1-iumylmethyl)-4-quinazolinyl]amino]-2-propanol IUPAC Name: (2S)-1-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]propan-2-ol Traditional Name: (2S)-1-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]propan-2-ol Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC(=NC2=CC=CC=C21)C[NH+]3CCCC3)O

Isomeric SMILES

C[C@@H](CNC1=NC(=NC2=CC=CC=C21)C[NH+]3CCCC3)O

InChI

InChI=1S/C16H22N4O/c1-12(21)10-17-16-13-6-2-3-7-14(13)18-15(19-16)11-20-8-4-5-9-20/h2-3,6-7,12,21H,4-5,8-11H2,1H3,(H,17,18,19)/p+1/t12-/m0/s1