ethyl 1-(1,3-benzodioxol-5-yl)-5-ethanoyl-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylate

Systemtic Name: ethyl 1-(1,3-benzodioxol-5-yl)-5-ethanoyl-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylate Openeye Name: ethyl 5-acetyl-1-(1,3-benzodioxol-5-yl)-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylate CAS Name: 5-acetyl-1-(1,3-benzodioxol-5-yl)-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-1-(1,3-benzodioxol-5-yl)-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylate Traditional Name: 5-acetyl-1-(1,3-benzodioxol-5-yl)-8-nitro-4H-pyrazolo[4,3-c]quinoline-3-carboxylic acid ethyl ester Formula: C22H18N4O7 MolecularWeight: 450.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(C3=C2C=C(C=C3)[N+](=O)[O-])C(=O)C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(C3=C2C=C(C=C3)[N+](=O)[O-])C(=O)C)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N4O7/c1-3-31-22(28)20-16-10-24(12(2)27)17-6-4-14(26(29)30)8-15(17)21(16)25(23-20)13-5-7-18-19(9-13)33-11-32-18/h4-9H,3,10-11H2,1-2H3