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

Systemtic Name: 2-[[(2S)-2-(3-azanylpropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate Openeye Name: 2-[[(2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate CAS Name: butanoic acid 2-[[(2S)-2-[(3-amino-1-oxopropyl)amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]ethyl ester IUPAC Name: 2-[[(2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl butanoate Traditional Name: butyric acid 2-[[(2S)-2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoyl]amino]ethyl ester Formula: C15H25N5O4 MolecularWeight: 339.3901

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCNC(=O)C(CC1=CN=CN1)NC(=O)CCN

Isomeric SMILES

CCCC(=O)OCCNC(=O)[C@H](CC1=CN=CN1)NC(=O)CCN

InChI

InChI=1S/C15H25N5O4/c1-2-3-14(22)24-7-6-18-15(23)12(20-13(21)4-5-16)8-11-9-17-10-19-11/h9-10,12H,2-8,16H2,1H3,(H,17,19)(H,18,23)(H,20,21)/t12-/m0/s1