N-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-3-oxidanylidene-butan-2-yl)-1H-indol-3-yl]propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-3-oxidanylidene-butan-2-yl)-1H-indol-3-yl]propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-[5-(1,1-dimethyl-2-oxo-propyl)-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-3-oxobutan-2-yl)-1H-indol-3-yl]propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-3-oxobutan-2-yl)-1H-indol-3-yl]propyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[2-(3,5-dimethylphenyl)-5-(2-keto-1,1-dimethyl-propyl)-1H-indol-3-yl]propyl]-4-nitro-benzenesulfonamide Formula: C30H33N3O5S MolecularWeight: 547.66512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)C)C(C)CNS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)C)C(C)CNS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C30H33N3O5S/c1-18-13-19(2)15-22(14-18)29-28(26-16-23(7-12-27(26)32-29)30(5,6)21(4)34)20(3)17-31-39(37,38)25-10-8-24(9-11-25)33(35)36/h7-16,20,31-32H,17H2,1-6H3