2-(4-chloranylphenoxy)-2-methyl-1-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-1-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazino]propan-1-one Formula: C24H29ClN4O7S MolecularWeight: 553.02766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H29ClN4O7S/c1-24(2,36-19-5-3-18(25)4-6-19)23(30)27-11-9-26(10-12-27)21-8-7-20(17-22(21)29(31)32)37(33,34)28-13-15-35-16-14-28/h3-8,17H,9-16H2,1-2H3