2-[[2-[[1-(1-carbamimidoylpiperidin-4-yl)carbonylazetidin-2-yl]carbonylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[[1-(1-carbamimidoylpiperidin-4-yl)carbonylazetidin-2-yl]carbonylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[[1-(1-carbamimidoylpiperidine-4-carbonyl)azetidine-2-carbonyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[[1-[(1-carbamimidoyl-4-piperidinyl)-oxomethyl]-2-azetidinyl]-oxomethyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[[1-(1-carbamimidoylpiperidine-4-carbonyl)azetidine-2-carbonyl]amino]-4-hydroxy-4-oxobutanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[[1-(1-amidinoisonipecotoyl)azetidine-2-carbonyl]amino]-4-hydroxy-4-keto-butanoyl]amino]-3-methyl-butyric acid Formula: C20H32N6O7 MolecularWeight: 468.50408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C1CCN1C(=O)C2CCN(CC2)C(=N)N

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C1CCN1C(=O)C2CCN(CC2)C(=N)N

InChI

InChI=1S/C20H32N6O7/c1-10(2)15(19(32)33)24-16(29)12(9-14(27)28)23-17(30)13-5-8-26(13)18(31)11-3-6-25(7-4-11)20(21)22/h10-13,15H,3-9H2,1-2H3,(H3,21,22)(H,23,30)(H,24,29)(H,27,28)(H,32,33)