N-[2-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-[2-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-[2-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-[2-keto-2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]ethyl]-4-nitro-benzamide Formula: C23H21N5O6 MolecularWeight: 463.44274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O6/c1-34-20-13-19(25-18-6-3-2-5-17(18)20)23(31)27-12-4-11-26(27)21(29)14-24-22(30)15-7-9-16(10-8-15)28(32)33/h2-3,5-10,13H,4,11-12,14H2,1H3,(H,24,30)