N-(3,3-diphenylpropyl)-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(3,3-diphenylpropyl)-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(3,3-diphenylpropyl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-(3,3-diphenylpropyl)-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(3,3-diphenylpropyl)-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(3,3-diphenylpropyl)-2-methyl-5-nitro-benzenesulfonamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4S/c1-17-12-13-20(24(25)26)16-22(17)29(27,28)23-15-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-13,16,21,23H,14-15H2,1H3