3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanoic acid

Systemtic Name: 3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-4-oxidanylidene-4-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butanoic acid Openeye Name: 4-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-3-[[2-[4-(3-guanidinopropyl)-2,5-dioxo-imidazolidin-1-yl]acetyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxo-1-imidazolidinyl]-1-oxoethyl]amino]-4-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-4-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-3-[[2-[4-(3-guanidinopropyl)-2,5-diketo-imidazolidin-1-yl]acetyl]amino]-4-keto-butyric acid Formula: C22H29N7O8 MolecularWeight: 519.50776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N

InChI

InChI=1S/C22H29N7O8/c23-21(24)25-8-4-7-13-19(34)29(22(37)28-13)11-16(30)26-14(10-17(31)32)18(33)27-15(20(35)36)9-12-5-2-1-3-6-12/h1-3,5-6,13-15H,4,7-11H2,(H,26,30)(H,27,33)(H,28,37)(H,31,32)(H,35,36)(H4,23,24,25)