2-[[4-[(2-butanoyloxy-2-pentanoyloxy-ethyl)amino]-4-oxidanylidene-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[[4-[(2-butanoyloxy-2-pentanoyloxy-ethyl)amino]-4-oxidanylidene-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[[4-[(2-butanoyloxy-2-pentanoyloxy-ethyl)amino]-4-oxo-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[1,4-dioxo-4-[[2-(1-oxobutoxy)-2-(1-oxopentoxy)ethyl]amino]butyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[[4-[(2-butanoyloxy-2-pentanoyloxyethyl)amino]-4-oxobutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[[4-[(2-butyryloxy-2-valeryloxy-ethyl)amino]-4-keto-butanoyl]amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C21H32N4O8 MolecularWeight: 468.50078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(CNC(=O)CCC(=O)NC(CC1=CN=CN1)C(=O)O)OC(=O)CCC

Isomeric SMILES

CCCCC(=O)OC(CNC(=O)CCC(=O)NC(CC1=CN=CN1)C(=O)O)OC(=O)CCC

InChI

InChI=1S/C21H32N4O8/c1-3-5-7-19(29)33-20(32-18(28)6-4-2)12-23-16(26)8-9-17(27)25-15(21(30)31)10-14-11-22-13-24-14/h11,13,15,20H,3-10,12H2,1-2H3,(H,22,24)(H,23,26)(H,25,27)(H,30,31)