2,4-bis(chloranyl)-6-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonyl-phenol

Systemtic Name: 2,4-bis(chloranyl)-6-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonyl-phenol Openeye Name: 2,4-dichloro-6-[3-methyl-4-(p-tolyl)piperazin-1-yl]sulfonyl-phenol CAS Name: 2,4-dichloro-6-[[3-methyl-4-(4-methylphenyl)-1-piperazinyl]sulfonyl]phenol IUPAC Name: 2,4-dichloro-6-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]sulfonylphenol Traditional Name: 2,4-dichloro-6-[3-methyl-4-(p-tolyl)piperazino]sulfonyl-phenol Formula: C18H20Cl2N2O3S MolecularWeight: 415.334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=CC(=C3O)Cl)Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=CC(=C3O)Cl)Cl

InChI

InChI=1S/C18H20Cl2N2O3S/c1-12-3-5-15(6-4-12)22-8-7-21(11-13(22)2)26(24,25)17-10-14(19)9-16(20)18(17)23/h3-6,9-10,13,23H,7-8,11H2,1-2H3