N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[4-cyano-2-(8-methoxy-4-methyl-quinolin-2-yl)pyrazol-3-yl]-4-methyl-3,5-dinitro-benzamide Openeye Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-4-methyl-3,5-dinitro-benzamide CAS Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolinyl)-3-pyrazolyl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-[4-cyano-2-(8-methoxy-4-methylquinolin-2-yl)pyrazol-3-yl]-4-methyl-3,5-dinitrobenzamide Traditional Name: N-[4-cyano-2-(8-methoxy-4-methyl-2-quinolyl)pyrazol-3-yl]-4-methyl-3,5-dinitro-benzamide Formula: C23H17N7O6 MolecularWeight: 487.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C23H17N7O6/c1-12-7-20(26-21-16(12)5-4-6-19(21)36-3)28-22(15(10-24)11-25-28)27-23(31)14-8-17(29(32)33)13(2)18(9-14)30(34)35/h4-9,11H,1-3H3,(H,27,31)