N-(3,3-diphenylpropyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(3,3-diphenylpropyl)-3-nitro-benzenesulfonamide Openeye Name: N-(3,3-diphenylpropyl)-3-nitro-benzenesulfonamide CAS Name: N-(3,3-diphenylpropyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(3,3-diphenylpropyl)-3-nitrobenzenesulfonamide Traditional Name: N-(3,3-diphenylpropyl)-3-nitro-benzenesulfonamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4S/c24-23(25)19-12-7-13-20(16-19)28(26,27)22-15-14-21(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-13,16,21-22H,14-15H2