2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-2-(4-piperonylpiperazino)acetamide Formula: C26H34N4O6S MolecularWeight: 530.63636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H34N4O6S/c1-34-23-8-6-21(16-25(23)37(32,33)30-9-3-2-4-10-30)27-26(31)18-29-13-11-28(12-14-29)17-20-5-7-22-24(15-20)36-19-35-22/h5-8,15-16H,2-4,9-14,17-19H2,1H3,(H,27,31)