1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one

Systemtic Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one Openeye Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one CAS Name: 1-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-3-(4-ethoxyphenoxy)-1-propanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-ethoxyphenoxy)propan-1-one Traditional Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-3-(4-ethoxyphenoxy)propan-1-one Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H30N2O5S/c1-4-29-20-7-9-21(10-8-20)30-16-11-23(26)24-12-14-25(15-13-24)31(27,28)22-17-18(2)5-6-19(22)3/h5-10,17H,4,11-16H2,1-3H3