4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propyl-benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propyl-benzenesulfonamide Openeye Name: 4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propyl-benzenesulfonamide CAS Name: 4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propylbenzenesulfonamide IUPAC Name: 4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propylbenzenesulfonamide Traditional Name: 4-methyl-N-[2-(4-nitrophenyl)ethynyl]-N-propyl-benzenesulfonamide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C#CC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCN(C#CC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H18N2O4S/c1-3-13-19(25(23,24)18-10-4-15(2)5-11-18)14-12-16-6-8-17(9-7-16)20(21)22/h4-11H,3,13H2,1-2H3