N-[(2,4-dimethoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-(2,4-dimethoxybenzyl)-1-mesyl-nipecotamide Formula: C16H24N2O5S MolecularWeight: 356.43716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C)OC

InChI

InChI=1S/C16H24N2O5S/c1-22-14-7-6-12(15(9-14)23-2)10-17-16(19)13-5-4-8-18(11-13)24(3,20)21/h6-7,9,13H,4-5,8,10-11H2,1-3H3,(H,17,19)