4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide Openeye Name: 4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide CAS Name: 4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide Traditional Name: 4-methyl-N-[1-(4-nitrophenyl)non-2-ynyl]benzenesulfonamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C1=CC=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC#CC(C1=CC=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H26N2O4S/c1-3-4-5-6-7-8-9-22(19-12-14-20(15-13-19)24(25)26)23-29(27,28)21-16-10-18(2)11-17-21/h10-17,22-23H,3-7H2,1-2H3