HIT ID: HIT212667725
Cas No: 1380006-72-3
分子式: C17H17NO5
分子量: 315.325
常用名: exo BCN-O-PNB
氢键受体数 (HBA): 4
氢键供体数 (HBD): 0
LogP: 4.393653
IUPAC: [(1R,8S,9R)-bicyclo[6.1.0]non-4-yn-9-yl]methyl 4-nitrophenyl carbonate
IUPAC: [(1R,8S,9R)-bicyclo[6.1.0]non-4-yn-9-yl]methyl 4-nitrophenyl carbonate
SMILES: [H][C@@]12CCC#CCC[C@]1([H])[C@H]2COC(=O)Oc1ccc(cc1)[N+]([O-])=O
SMILES: [H][C@@]12CCC#CCC[C@]1([H])[C@H]2COC(=O)Oc1ccc(cc1)[N+]([O-])=O
InChI key: QXNXOXMDBLHIDB-ZSHCYNCHSA-N