(2R)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]hexanoate

Systemtic Name: (2R)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]hexanoate Openeye Name: (2R)-2-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]amino]hexanoate CAS Name: (2R)-2-[[2-[2-(dimethylammonio)ethyl]-4-quinazolinyl]amino]hexanoate IUPAC Name: (2R)-2-[[2-[2-(dimethylazaniumyl)ethyl]quinazolin-4-yl]amino]hexanoate Traditional Name: (2R)-2-[[2-[2-(dimethylammonio)ethyl]quinazolin-4-yl]amino]hexanoate Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

Isomeric SMILES

CCCC[C@H](C(=O)[O-])NC1=NC(=NC2=CC=CC=C21)CC[NH+](C)C

InChI

InChI=1S/C18H26N4O2/c1-4-5-9-15(18(23)24)20-17-13-8-6-7-10-14(13)19-16(21-17)11-12-22(2)3/h6-8,10,15H,4-5,9,11-12H2,1-3H3,(H,23,24)(H,19,20,21)/t15-/m1/s1