N-(2-dimethylaminoethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-[1-(2-mesylbenzyl)-4-piperidyl]-piperonylamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(C)CCN(C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H33N3O5S/c1-26(2)14-15-28(25(29)19-8-9-22-23(16-19)33-18-32-22)21-10-12-27(13-11-21)17-20-6-4-5-7-24(20)34(3,30)31/h4-9,16,21H,10-15,17-18H2,1-3H3