2-[(E)-2-(4-nitrophenyl)ethenyl]-7-oxa-3-azabicyclo[6.4.0]dodeca-2,8,10,12-tetraen-5-ol hydrate

Molecular Formula: C₃₆H₃₄N₄O₉

InChI: InChI=1/2C18H16N2O4.H2O/c2*21-15-11-19-17(16-3-1-2-4-18(16)24-12-15)10-7-13-5-8-14(9-6-13)20(22)23;/h2*1-10,15,21H,11-12H2;1H2/b2*10-7+,19-17-;

InChIKey: InChIKey=QDKMPVDCLGAMDG-ZQMQWNBTBE
SMILES: C1C(COC2=CC=CC=C2C(=N1)C=CC3=CC=C(C=C3)[N+](=O)[O-])O.C1C(COC2=CC=CC=C2C(=N1)C=CC3=CC=C(C=C3)[N+](=O)[O-])O.O

Names:
    2H-1,5-Benzoxazocine, 3,4-dihydro-3-hydroxy-6-(p-nitrostyryl)-, hemihydrate
    2H-1,5-BENZOXAZOCIN-3-OL, 3,4-DIHYDRO-6-(p-NITROSTYRYL)-, HEMIHYDRATE
    2-[(E)-2-(4-nitrophenyl)ethenyl]-7-oxa-3-azabicyclo[6.4.0]dodeca-2,8,10,12-tetraen-5-ol hydrate
    3,4-Dihydro-3-hydroxy-6-(p-nitrostyryl)-1,5-benzoxazocine hemihydrate
    67031-47-4

Registries:
    PubChem CID 6434943
    PubChem ID 187797