(2S)-2-[(6-ethylquinazolin-4-yl)azaniumyl]hexanoate

Systemtic Name: (2S)-2-[(6-ethylquinazolin-4-yl)azaniumyl]hexanoate Openeye Name: (2S)-2-[(6-ethylquinazolin-4-yl)ammonio]hexanoate CAS Name: (2S)-2-[(6-ethyl-4-quinazolinyl)ammonio]hexanoate IUPAC Name: (2S)-2-[(6-ethylquinazolin-4-yl)azaniumyl]hexanoate Traditional Name: (2S)-2-[(6-ethylquinazolin-4-yl)ammonio]hexanoate Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])[NH2+]C1=NC=NC2=C1C=C(C=C2)CC

Isomeric SMILES

CCCC[C@@H](C(=O)[O-])[NH2+]C1=NC=NC2=C1C=C(C=C2)CC

InChI

InChI=1S/C16H21N3O2/c1-3-5-6-14(16(20)21)19-15-12-9-11(4-2)7-8-13(12)17-10-18-15/h7-10,14H,3-6H2,1-2H3,(H,20,21)(H,17,18,19)/t14-/m0/s1