5-(dimethylamino)-N-[(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]naphthalene-1-sulfonamide

Systemtic Name: 5-(dimethylamino)-N-[(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]naphthalene-1-sulfonamide Openeye Name: 5-(dimethylamino)-N-[(1R,2R,3S,4R)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]naphthalene-1-sulfonamide CAS Name: 5-(dimethylamino)-N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]-1-naphthalenesulfonamide IUPAC Name: 5-(dimethylamino)-N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]naphthalene-1-sulfonamide Traditional Name: 5-(dimethylamino)-N-[(1R,2R,3S,4R)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]naphthalene-1-sulfonamide Formula: C18H24N2O7S MolecularWeight: 412.45736

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(C=O)C(C(C(CO)O)O)O

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O

InChI

InChI=1S/C18H24N2O7S/c1-20(2)14-7-3-6-12-11(14)5-4-8-16(12)28(26,27)19-13(9-21)17(24)18(25)15(23)10-22/h3-9,13,15,17-19,22-25H,10H2,1-2H3/t13-,15+,17+,18+/m0/s1