N-[2-(3-methylphenyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3-methylphenyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(m-tolyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(3-methylphenyl)ethyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(3-methylphenyl)ethyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(m-tolyl)ethyl]-1-propylsulfonyl-nipecotamide Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCC2=CC=CC(=C2)C

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCC2=CC=CC(=C2)C

InChI

InChI=1S/C18H28N2O3S/c1-3-12-24(22,23)20-11-5-8-17(14-20)18(21)19-10-9-16-7-4-6-15(2)13-16/h4,6-7,13,17H,3,5,8-12,14H2,1-2H3,(H,19,21)