N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H29N3O5S/c1-28-19-5-3-18(4-6-19)25-13-11-24(12-14-25)10-2-9-23-31(26,27)20-7-8-21-22(17-20)30-16-15-29-21/h3-8,17,23H,2,9-16H2,1H3