4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitro-phenyl]sulfonyl-benzamide

Systemtic Name: 4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitro-phenyl]sulfonyl-benzamide Openeye Name: 4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitro-phenyl]sulfonyl-benzamide CAS Name: 4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitrophenyl]sulfonylbenzamide IUPAC Name: 4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitrophenyl]sulfonylbenzamide Traditional Name: 4-(4-fluorophenyl)-N-[4-(2-hydroxyethylamino)-3-nitro-phenyl]sulfonyl-benzamide Formula: C21H18FN3O6S MolecularWeight: 459.447523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)F)C(=O)NS(=O)(=O)C3=CC(=C(C=C3)NCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)F)C(=O)NS(=O)(=O)C3=CC(=C(C=C3)NCCO)[N+](=O)[O-]

InChI

InChI=1S/C21H18FN3O6S/c22-17-7-5-15(6-8-17)14-1-3-16(4-2-14)21(27)24-32(30,31)18-9-10-19(23-11-12-26)20(13-18)25(28)29/h1-10,13,23,26H,11-12H2,(H,24,27)