4-fluoranyl-N-[1-[(E)-3-(4-nitrophenyl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-[(E)-3-(4-nitrophenyl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-4-piperidyl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-[(E)-3-(4-nitrophenyl)prop-2-enoyl]piperidin-4-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-[(E)-3-(4-nitrophenyl)acryloyl]-4-piperidyl]benzenesulfonamide Formula: C20H20FN3O5S MolecularWeight: 433.453303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)F)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20FN3O5S/c21-16-4-8-19(9-5-16)30(28,29)22-17-11-13-23(14-12-17)20(25)10-3-15-1-6-18(7-2-15)24(26)27/h1-10,17,22H,11-14H2/b10-3+