HIT ID: HIT212059058
Cas No: 6265-30-1
分子式: C9H9NO2
分子量: 163.176
常用名: rel-(3aR,4S,7R,7aS)-3a,4,7,7a-Tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
常用名: rel-(3aR,4S,7R,7aS)-3a,4,7,7a-Tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: -0.1782656
IUPAC: (1R,2S,6R,7S)-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione
IUPAC: (1R,2S,6R,7S)-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione
SMILES: [H][C@]12C[C@]([H])(C=C1)[C@]1([H])C(=O)NC(=O)[C@]21[H]
SMILES: [H][C@]12C[C@]([H])(C=C1)[C@]1([H])C(=O)NC(=O)[C@]21[H]
InChI key: GPIUUMROPXDNRH-UMRXKNAASA-N
