N-(1,3-diphenylprop-2-ynyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-diphenylprop-2-ynyl)-4-nitro-benzenesulfonamide Openeye Name: N-(1,3-diphenylprop-2-ynyl)-4-nitro-benzenesulfonamide CAS Name: N-(1,3-diphenylprop-2-ynyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(1,3-diphenylprop-2-ynyl)-4-nitrobenzenesulfonamide Traditional Name: N-(1,3-diphenylprop-2-ynyl)-4-nitro-benzenesulfonamide Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O4S/c24-23(25)19-12-14-20(15-13-19)28(26,27)22-21(18-9-5-2-6-10-18)16-11-17-7-3-1-4-8-17/h1-10,12-15,21-22H