2-(5-chloranylthiophen-2-yl)-N-(4-ethoxy-2-nitro-phenyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-(4-ethoxy-2-nitro-phenyl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-(4-ethoxy-2-nitro-phenyl)quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-(4-ethoxy-2-nitrophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-(4-ethoxy-2-nitrophenyl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-(4-ethoxy-2-nitro-phenyl)cinchoninamide Formula: C22H16ClN3O4S MolecularWeight: 453.89814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H16ClN3O4S/c1-2-30-13-7-8-17(19(11-13)26(28)29)25-22(27)15-12-18(20-9-10-21(23)31-20)24-16-6-4-3-5-14(15)16/h3-12H,2H2,1H3,(H,25,27)