[4-(2-methylpropylsulfonyl)-6-nitro-1-phenyl-indazol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [4-(2-methylpropylsulfonyl)-6-nitro-1-phenyl-indazol-3-yl]-piperidin-1-yl-methanone Openeye Name: (4-isobutylsulfonyl-6-nitro-1-phenyl-indazol-3-yl)-(1-piperidyl)methanone CAS Name: [4-(2-methylpropylsulfonyl)-6-nitro-1-phenyl-3-indazolyl]-(1-piperidinyl)methanone IUPAC Name: [4-(2-methylpropylsulfonyl)-6-nitro-1-phenylindazol-3-yl]-piperidin-1-ylmethanone Traditional Name: (4-isobutylsulfonyl-6-nitro-1-phenyl-indazol-3-yl)-piperidino-methanone Formula: C23H26N4O5S MolecularWeight: 470.54134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])N(N=C2C(=O)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CS(=O)(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])N(N=C2C(=O)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O5S/c1-16(2)15-33(31,32)20-14-18(27(29)30)13-19-21(20)22(23(28)25-11-7-4-8-12-25)24-26(19)17-9-5-3-6-10-17/h3,5-6,9-10,13-14,16H,4,7-8,11-12,15H2,1-2H3