N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide

Systemtic Name: N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide Openeye Name: N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide CAS Name: N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzamide IUPAC Name: N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzamide Traditional Name: N-[1-(4-fluorophenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzamide Formula: C22H18FN3O5S MolecularWeight: 455.458823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N(C1)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N(C1)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN3O5S/c23-17-7-10-20(11-8-17)32(30,31)25-12-2-4-15-6-9-18(14-21(15)25)24-22(27)16-3-1-5-19(13-16)26(28)29/h1,3,5-11,13-14H,2,4,12H2,(H,24,27)