1-(4-butoxyphenyl)sulfonyl-4-(5-chloranyl-2-methyl-phenyl)piperazine

Systemtic Name: 1-(4-butoxyphenyl)sulfonyl-4-(5-chloranyl-2-methyl-phenyl)piperazine Openeye Name: 1-(4-butoxyphenyl)sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine CAS Name: 1-(4-butoxyphenyl)sulfonyl-4-(5-chloro-2-methylphenyl)piperazine IUPAC Name: 1-(4-butoxyphenyl)sulfonyl-4-(5-chloro-2-methylphenyl)piperazine Traditional Name: 1-(4-butoxyphenyl)sulfonyl-4-(5-chloro-2-methyl-phenyl)piperazine Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C21H27ClN2O3S/c1-3-4-15-27-19-7-9-20(10-8-19)28(25,26)24-13-11-23(12-14-24)21-16-18(22)6-5-17(21)2/h5-10,16H,3-4,11-15H2,1-2H3