AC1NUQ3O
(4-nitrophenyl) (2S)-6-diazo-2-(1,3-dioxoisoindol-2-yl)-5-oxohexanoate
Also Known As: 2H-Isoindole-2-acetic acid, alpha-(4-diazo-3-oxobutyl)-1,3-dihydro-1,3-dioxo-, 4-nitrophenyl ester, (S)-|(Z,5S)-1-diazonio-5-(1,3-dioxoisoindol-2-yl)-6-(4-nitrophenoxy)-6-oxohex-1-en-2-olate|(Z,5S)-1-diazonio-5-(1,3-dioxoisoindol-2-yl)-5-(4-nitrophenoxy)carbonyl-pent-1-en-2-olate|2H-Isoindole-2-acetic acid, .alpha.-(4-diazo-3-oxobutyl)-1,3-dihydro-1,3-dioxo-, 4-nitrophenyl ester, (S)-
| Molecular Formula | C20H14N4O7 |
|---|---|
| Molecular Weight | 422.08624 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 422.08624 |
| Monoisotopic Mass | 422.08624 |
| Heavy Atoms | 31 |
| Complexity | 785.0 |
Chemical Identifiers
| CAS Number | 38236-38-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)[C@@H](CCC(=O)C=[N+]=[N-])C(=O)OC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | FMEFUKYZIBICGY-KRWDZBQOSA-N |
Product Overview
AC1NUQ3O (CAS 38236-38-3), with molecular formula C20H14N4O7 and molecular weight 422.08624 g/mol. IUPAC: (4-nitrophenyl) (2S)-6-diazo-2-(1,3-dioxoisoindol-2-yl)-5-oxohexanoate.
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