2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methoxy-4-phenylmethoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide

Systemtic Name: 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methoxy-4-phenylmethoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide Openeye Name: 4-benzyloxy-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide CAS Name: 2-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-5-methoxy-4-phenylmethoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide IUPAC Name: 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methoxy-4-phenylmethoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide Traditional Name: 4-benzoxy-2-[3-[4-(4-fluorophenyl)piperazino]propyl]-5-methoxy-3,4-dihydro-1$l^{6},2-benzothiazine 1,1-dioxide Formula: C29H34FN3O4S MolecularWeight: 539.661363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(CN(S(=O)(=O)C2=CC=C1)CCCN3CCN(CC3)C4=CC=C(C=C4)F)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C2C(CN(S(=O)(=O)C2=CC=C1)CCCN3CCN(CC3)C4=CC=C(C=C4)F)OCC5=CC=CC=C5

InChI

InChI=1S/C29H34FN3O4S/c1-36-26-9-5-10-28-29(26)27(37-22-23-7-3-2-4-8-23)21-33(38(28,34)35)16-6-15-31-17-19-32(20-18-31)25-13-11-24(30)12-14-25/h2-5,7-14,27H,6,15-22H2,1H3