N-(4-butoxyphenyl)-N'-[(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]ethanediamide

Systemtic Name: N-(4-butoxyphenyl)-N'-[(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]ethanediamide Openeye Name: N-(4-butoxyphenyl)-N'-[(1R,2R,3S,4R)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]oxamide CAS Name: N-(4-butoxyphenyl)-N'-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]oxamide IUPAC Name: N-(4-butoxyphenyl)-N'-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]oxamide Traditional Name: N-(4-butoxyphenyl)-N'-[(1R,2R,3S,4R)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]oxamide Formula: C18H26N2O8 MolecularWeight: 398.40764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C(=O)NC(C=O)C(C(C(CO)O)O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O

InChI

InChI=1S/C18H26N2O8/c1-2-3-8-28-12-6-4-11(5-7-12)19-17(26)18(27)20-13(9-21)15(24)16(25)14(23)10-22/h4-7,9,13-16,22-25H,2-3,8,10H2,1H3,(H,19,26)(H,20,27)/t13-,14+,15+,16+/m0/s1