2-[[(2S)-2-[[(2S)-6-azaniumyl-2-azanyl-hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]ethanoate

Systemtic Name: 2-[[(2S)-2-[[(2S)-6-azaniumyl-2-azanyl-hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]ethanoate Openeye Name: 2-[[(2S)-2-[[(2S)-2-amino-6-azaniumyl-hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]acetate CAS Name: 2-[[(2S)-2-[[(2S)-2-amino-6-ammonio-1-oxohexyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]acetate IUPAC Name: 2-[[(2S)-2-[[(2S)-2-amino-6-azaniumylhexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-[[(2S)-2-amino-6-ammonio-hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]acetate Formula: C14H24N6O4 MolecularWeight: 340.37816

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)NCC(=O)[O-])NC(=O)C(CCCC[NH3+])N

Isomeric SMILES

C1=C(NC=N1)C[C@@H](C(=O)NCC(=O)[O-])NC(=O)[C@H](CCCC[NH3+])N

InChI

InChI=1S/C14H24N6O4/c15-4-2-1-3-10(16)13(23)20-11(5-9-6-17-8-19-9)14(24)18-7-12(21)22/h6,8,10-11H,1-5,7,15-16H2,(H,17,19)(H,18,24)(H,20,23)(H,21,22)/t10-,11-/m0/s1