1-[(4-ethoxy-3-methoxy-phenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine Openeye Name: 1-[(4-ethoxy-3-methoxy-phenyl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine Traditional Name: 1-(4-ethoxy-3-methoxy-benzyl)-4-(4-methoxyphenyl)sulfonyl-piperazine Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O5S/c1-4-28-20-10-5-17(15-21(20)27-3)16-22-11-13-23(14-12-22)29(24,25)19-8-6-18(26-2)7-9-19/h5-10,15H,4,11-14,16H2,1-3H3