(2-methyl-2,3-dihydroindol-1-yl)-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: (2-methyl-2,3-dihydroindol-1-yl)-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: (2-methylindolin-1-yl)-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: (2-methyl-2,3-dihydroindol-1-yl)-[1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: (2-methyl-2,3-dihydroindol-1-yl)-[1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: (2-methylindolin-1-yl)-[1-(2-methyl-5-nitro-phenyl)sulfonyl-4-piperidyl]methanone Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H25N3O5S/c1-15-7-8-19(25(27)28)14-21(15)31(29,30)23-11-9-17(10-12-23)22(26)24-16(2)13-18-5-3-4-6-20(18)24/h3-8,14,16-17H,9-13H2,1-2H3