1-[(4-chlorophenyl)methoxy]-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]propan-2-ol

Systemtic Name: 1-[(4-chlorophenyl)methoxy]-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-[(4-chlorophenyl)methoxy]-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-[(4-chlorophenyl)methoxy]-3-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-[(4-chlorophenyl)methoxy]-3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(4-chlorobenzyl)oxy-3-[4-(3,4-dimethylphenyl)sulfonylpiperazino]propan-2-ol Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COCC3=CC=C(C=C3)Cl)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COCC3=CC=C(C=C3)Cl)O)C

InChI

InChI=1S/C22H29ClN2O4S/c1-17-3-8-22(13-18(17)2)30(27,28)25-11-9-24(10-12-25)14-21(26)16-29-15-19-4-6-20(23)7-5-19/h3-8,13,21,26H,9-12,14-16H2,1-2H3