4-chloranyl-N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(4-fluorophenoxy)-5-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(4-fluorophenoxy)-5-morpholin-4-ylsulfonylphenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-3-nitro-benzamide Formula: C23H19ClFN3O7S MolecularWeight: 535.929263

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)F)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)F)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H19ClFN3O7S/c24-19-7-1-15(13-21(19)28(30)31)23(29)26-20-14-18(36(32,33)27-9-11-34-12-10-27)6-8-22(20)35-17-4-2-16(25)3-5-17/h1-8,13-14H,9-12H2,(H,26,29)