1-[(2,5-dimethoxyphenyl)methyl]-4-(3,4-dimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(3,4-dimethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(3,4-dimethylphenyl)sulfonyl-piperazine CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(3,4-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(3,4-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(2,5-dimethoxybenzyl)-4-(3,4-dimethylphenyl)sulfonyl-piperazine Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H28N2O4S/c1-16-5-7-20(13-17(16)2)28(24,25)23-11-9-22(10-12-23)15-18-14-19(26-3)6-8-21(18)27-4/h5-8,13-14H,9-12,15H2,1-4H3