N'-[[2-(1,3-benzodioxol-5-yl)phenyl]methyl]-N-oxidanyl-N'-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]butanediamide

Systemtic Name: N'-[[2-(1,3-benzodioxol-5-yl)phenyl]methyl]-N-oxidanyl-N'-[(1S,2R)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]butanediamide Openeye Name: N-[[2-(1,3-benzodioxol-5-yl)phenyl]methyl]-4-(hydroxyamino)-N-[(1S,2R)-2-hydroxyindan-1-yl]-4-oxo-butanamide CAS Name: N'-[[2-(1,3-benzodioxol-5-yl)phenyl]methyl]-N-hydroxy-N'-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]butanediamide IUPAC Name: N'-[[2-(1,3-benzodioxol-5-yl)phenyl]methyl]-N-hydroxy-N'-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]butanediamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)benzyl]-4-(hydroxyamino)-N-[(1S,2R)-2-hydroxyindan-1-yl]-4-keto-butyramide Formula: C27H26N2O6 MolecularWeight: 474.50514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C21)N(CC3=CC=CC=C3C4=CC5=C(C=C4)OCO5)C(=O)CCC(=O)NO)O

Isomeric SMILES

C1[C@H]([C@H](C2=CC=CC=C21)N(CC3=CC=CC=C3C4=CC5=C(C=C4)OCO5)C(=O)CCC(=O)NO)O

InChI

InChI=1S/C27H26N2O6/c30-22-13-17-5-1-4-8-21(17)27(22)29(26(32)12-11-25(31)28-33)15-19-6-2-3-7-20(19)18-9-10-23-24(14-18)35-16-34-23/h1-10,14,22,27,30,33H,11-13,15-16H2,(H,28,31)/t22-,27+/m1/s1