3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethylpiperazin-1-yl)propan-1-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-(4-phenethylpiperazino)propan-1-one Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H28N2O5S/c26-23(25-13-11-24(12-14-25)10-8-19-4-2-1-3-5-19)9-17-31(27,28)20-6-7-21-22(18-20)30-16-15-29-21/h1-7,18H,8-17H2