[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[3-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: (3-piperidinosulfonylphenyl)-(4-piperonylpiperazino)methanone Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H29N3O5S/c28-24(20-5-4-6-21(16-20)33(29,30)27-9-2-1-3-10-27)26-13-11-25(12-14-26)17-19-7-8-22-23(15-19)32-18-31-22/h4-8,15-16H,1-3,9-14,17-18H2