1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-[(2-methyl-5-nitro-phenyl)amino]ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-[(2-methyl-5-nitro-phenyl)amino]ethanone Openeye Name: 1-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-(2-methyl-5-nitro-anilino)ethanone CAS Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-(2-methyl-5-nitroanilino)ethanone IUPAC Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-(2-methyl-5-nitroanilino)ethanone Traditional Name: 1-(4-indan-5-ylsulfonylpiperazino)-2-(2-methyl-5-nitro-anilino)ethanone Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C22H26N4O5S/c1-16-5-7-19(26(28)29)14-21(16)23-15-22(27)24-9-11-25(12-10-24)32(30,31)20-8-6-17-3-2-4-18(17)13-20/h5-8,13-14,23H,2-4,9-12,15H2,1H3