4-[2-(2-azanylethanoylamino)ethanoylamino]-5-[[2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[2-(2-azanylethanoylamino)ethanoylamino]-5-[[2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[2-[(2-aminoacetyl)amino]acetyl]amino]-5-[[2-[[2-(carboxymethylamino)-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-5-[[2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-[(2-aminoacetyl)amino]acetyl]amino]-5-[[2-[[1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 5-[[2-[[2-(carboxymethylamino)-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-2-keto-ethyl]amino]-4-[[2-(glycylamino)acetyl]amino]-5-keto-valeric acid Formula: C19H28N8O9 MolecularWeight: 512.47382

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)NCC(=O)O)NC(=O)CNC(=O)C(CCC(=O)O)NC(=O)CNC(=O)CN

Isomeric SMILES

C1=C(NC=N1)CC(C(=O)NCC(=O)O)NC(=O)CNC(=O)C(CCC(=O)O)NC(=O)CNC(=O)CN

InChI

InChI=1S/C19H28N8O9/c20-4-13(28)22-6-14(29)26-11(1-2-16(31)32)18(35)23-7-15(30)27-12(3-10-5-21-9-25-10)19(36)24-8-17(33)34/h5,9,11-12H,1-4,6-8,20H2,(H,21,25)(H,22,28)(H,23,35)(H,24,36)(H,26,29)(H,27,30)(H,31,32)(H,33,34)