2-[2-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]ethanoylamino]ethanoate

Systemtic Name: 2-[2-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]ethanoylamino]ethanoate Openeye Name: 2-[[2-[[2-[(dimethylammonio)methyl]quinazolin-4-yl]amino]acetyl]amino]acetate CAS Name: 2-[[2-[[2-[(dimethylammonio)methyl]-4-quinazolinyl]amino]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[[2-[(dimethylazaniumyl)methyl]quinazolin-4-yl]amino]acetyl]amino]acetate Traditional Name: 2-[[2-[[2-[(dimethylammonio)methyl]quinazolin-4-yl]amino]acetyl]amino]acetate Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NCC(=O)NCC(=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C15H19N5O3/c1-20(2)9-12-18-11-6-4-3-5-10(11)15(19-12)17-7-13(21)16-8-14(22)23/h3-6H,7-9H2,1-2H3,(H,16,21)(H,22,23)(H,17,18,19)