2-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate dihydrochloride

Systemtic Name: 2-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate dihydrochloride Openeye Name: 2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate dihydrochloride CAS Name: butanoic acid 2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]ethyl ester dihydrochloride IUPAC Name: 2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate dihydrochloride Traditional Name: butyric acid 2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl ester dihydrochloride Formula: C12H22Cl2N4O3 MolecularWeight: 341.23408

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCNC(=O)C(CC1=CN=CN1)N.Cl.Cl

Isomeric SMILES

CCCC(=O)OCCNC(=O)[C@H](CC1=CN=CN1)N.Cl.Cl

InChI

InChI=1S/C12H20N4O3.2ClH/c1-2-3-11(17)19-5-4-15-12(18)10(13)6-9-7-14-8-16-9;;/h7-8,10H,2-6,13H2,1H3,(H,14,16)(H,15,18);2*1H/t10-;;/m0../s1