N-[2-(3,4-diethoxyphenyl)ethyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-mesyl-nipecotamide Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCCN(C2)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCCN(C2)S(=O)(=O)C)OCC

InChI

InChI=1S/C19H30N2O5S/c1-4-25-17-9-8-15(13-18(17)26-5-2)10-11-20-19(22)16-7-6-12-21(14-16)27(3,23)24/h8-9,13,16H,4-7,10-12,14H2,1-3H3,(H,20,22)