1-[4-(4-chloranyl-2-methyl-phenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine

Systemtic Name: 1-[4-(4-chloranyl-2-methyl-phenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[4-(4-chloro-2-methyl-phenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine CAS Name: 1-[4-(4-chloro-2-methylphenoxy)-3-nitrophenyl]sulfonyl-4-methylpiperazine IUPAC Name: 1-[4-(4-chloro-2-methylphenoxy)-3-nitrophenyl]sulfonyl-4-methylpiperazine Traditional Name: 1-[4-(4-chloro-2-methyl-phenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O5S/c1-13-11-14(19)3-5-17(13)27-18-6-4-15(12-16(18)22(23)24)28(25,26)21-9-7-20(2)8-10-21/h3-6,11-12H,7-10H2,1-2H3