N-(6-methoxy-1-propyl-pyrazolo[3,4-b]quinolin-3-yl)-3-nitro-benzamide

Systemtic Name: N-(6-methoxy-1-propyl-pyrazolo[3,4-b]quinolin-3-yl)-3-nitro-benzamide Openeye Name: N-(6-methoxy-1-propyl-pyrazolo[3,4-b]quinolin-3-yl)-3-nitro-benzamide CAS Name: N-(6-methoxy-1-propyl-3-pyrazolo[3,4-b]quinolinyl)-3-nitrobenzamide IUPAC Name: N-(6-methoxy-1-propylpyrazolo[3,4-b]quinolin-3-yl)-3-nitrobenzamide Traditional Name: N-(6-methoxy-1-propyl-pyrazolo[3,4-b]quinolin-3-yl)-3-nitro-benzamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C3C=C(C=CC3=N2)OC)C(=N1)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C3C=C(C=CC3=N2)OC)C(=N1)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O4/c1-3-9-25-20-17(12-14-11-16(30-2)7-8-18(14)22-20)19(24-25)23-21(27)13-5-4-6-15(10-13)26(28)29/h4-8,10-12H,3,9H2,1-2H3,(H,23,24,27)