2-methylpropyl 2-(4-butoxyphenyl)-4-methyl-8-[(4-nitrophenyl)methylidene]-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate

Molecular Formula: C29H31N3O6S


InChI: InChI=1/C29H31N3O6S/c1-5-6-15-37-23-13-9-21(10-14-23)26-25(28(34)38-17-18(2)3)19(4)30-29-31(26)27(33)24(39-29)16-20-7-11-22(12-8-20)32(35)36/h7-14,16,18,26H,5-6,15,17H2,1-4H3

InChIKey: InChIKey=RQECQXIOQKTAQP-UHFFFAOYAJ
SMILES: CCCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=C(C=C4)[N+](=O)[O-])S3)C)C(=O)OCC(C)C

Names:
    2-methylpropyl 2-(4-butoxyphenyl)-4-methyl-8-[(4-nitrophenyl)methylidene]-9-oxo-7-thia-1,5-diazabicyclo[4.3.0]nona-3,5-diene-3-carboxylate

Registries:
    PubChem CID 4471991
    PubChem ID 6592311