1-(4-chlorophenyl)sulfonyl-4-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]piperazine

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-[(3-ethoxy-4-prop-2-enoxy-phenyl)methyl]piperazine Openeye Name: 1-[(4-allyloxy-3-ethoxy-phenyl)methyl]-4-(4-chlorophenyl)sulfonyl-piperazine CAS Name: 1-(4-chlorophenyl)sulfonyl-4-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]piperazine IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-[(3-ethoxy-4-prop-2-enoxyphenyl)methyl]piperazine Traditional Name: 1-(4-allyloxy-3-ethoxy-benzyl)-4-(4-chlorophenyl)sulfonyl-piperazine Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)OCC=C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)OCC=C

InChI

InChI=1S/C22H27ClN2O4S/c1-3-15-29-21-10-5-18(16-22(21)28-4-2)17-24-11-13-25(14-12-24)30(26,27)20-8-6-19(23)7-9-20/h3,5-10,16H,1,4,11-15,17H2,2H3