[7-ethyl-1-(3-methylsulfonylpropyl)indol-3-yl]-(2-methylsulfonyl-3-nitro-phenyl)methanone

Systemtic Name: [7-ethyl-1-(3-methylsulfonylpropyl)indol-3-yl]-(2-methylsulfonyl-3-nitro-phenyl)methanone Openeye Name: [7-ethyl-1-(3-methylsulfonylpropyl)indol-3-yl]-(2-methylsulfonyl-3-nitro-phenyl)methanone CAS Name: [7-ethyl-1-(3-methylsulfonylpropyl)-3-indolyl]-(2-methylsulfonyl-3-nitrophenyl)methanone IUPAC Name: [7-ethyl-1-(3-methylsulfonylpropyl)indol-3-yl]-(2-methylsulfonyl-3-nitrophenyl)methanone Traditional Name: [7-ethyl-1-(3-mesylpropyl)indol-3-yl]-(2-mesyl-3-nitro-phenyl)methanone Formula: C22H24N2O7S2 MolecularWeight: 492.56516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N(C=C2C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])S(=O)(=O)C)CCCS(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC2=C1N(C=C2C(=O)C3=C(C(=CC=C3)[N+](=O)[O-])S(=O)(=O)C)CCCS(=O)(=O)C

InChI

InChI=1S/C22H24N2O7S2/c1-4-15-8-5-9-16-18(14-23(20(15)16)12-7-13-32(2,28)29)21(25)17-10-6-11-19(24(26)27)22(17)33(3,30)31/h5-6,8-11,14H,4,7,12-13H2,1-3H3