1-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[5-(2-chloro-4-nitro-phenyl)furan-2-carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[5-(2-chloro-4-nitrophenyl)-2-furanyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[5-(2-chloro-4-nitrophenyl)furan-2-carbonyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[5-(2-chloro-4-nitro-phenyl)-2-furoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H15ClN2O6 MolecularWeight: 426.8066

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C(=O)O

InChI

InChI=1S/C21H15ClN2O6/c22-16-11-12(24(28)29)6-7-15(16)18-8-9-19(30-18)20(25)23-10-2-4-13-14(21(26)27)3-1-5-17(13)23/h1,3,5-9,11H,2,4,10H2,(H,26,27)