2-chloranyl-N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[4-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-piperazinyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazino]phenyl]-4-nitro-benzamide Formula: C28H24ClN5O5 MolecularWeight: 545.97366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=C(C=C(C=C5)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=C(C=C(C=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C28H24ClN5O5/c1-39-26-17-25(31-24-5-3-2-4-22(24)26)28(36)33-14-12-32(13-15-33)19-8-6-18(7-9-19)30-27(35)21-11-10-20(34(37)38)16-23(21)29/h2-11,16-17H,12-15H2,1H3,(H,30,35)