3-azanyl-N-[3-[[3,4-bis(oxidanyl)phenyl]carbonylamino]-2-oxidanylidene-imidazolidin-1-yl]sulfonyl-2-oxidanylidene-azetidine-1-carboxamide

Systemtic Name: 3-azanyl-N-[3-[[3,4-bis(oxidanyl)phenyl]carbonylamino]-2-oxidanylidene-imidazolidin-1-yl]sulfonyl-2-oxidanylidene-azetidine-1-carboxamide Openeye Name: 3-amino-N-[3-[(3,4-dihydroxybenzoyl)amino]-2-oxo-imidazolidin-1-yl]sulfonyl-2-oxo-azetidine-1-carboxamide CAS Name: 3-amino-N-[[3-[[(3,4-dihydroxyphenyl)-oxomethyl]amino]-2-oxo-1-imidazolidinyl]sulfonyl]-2-oxo-1-azetidinecarboxamide IUPAC Name: 3-amino-N-[3-[(3,4-dihydroxybenzoyl)amino]-2-oxoimidazolidin-1-yl]sulfonyl-2-oxoazetidine-1-carboxamide Traditional Name: 3-amino-2-keto-N-[2-keto-3-(protocatechuoylamino)imidazolidin-1-yl]sulfonyl-azetidine-1-carboxamide Formula: C14H16N6O8S MolecularWeight: 428.37724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1NC(=O)C2=CC(=C(C=C2)O)O)S(=O)(=O)NC(=O)N3CC(C3=O)N

Isomeric SMILES

C1CN(C(=O)N1NC(=O)C2=CC(=C(C=C2)O)O)S(=O)(=O)NC(=O)N3CC(C3=O)N

InChI

InChI=1S/C14H16N6O8S/c15-8-6-18(12(8)24)13(25)17-29(27,28)20-4-3-19(14(20)26)16-11(23)7-1-2-9(21)10(22)5-7/h1-2,5,8,21-22H,3-4,6,15H2,(H,16,23)(H,17,25)