1-ethylsulfonyl-N-[2-methyl-1-(4-propylphenyl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-[2-methyl-1-(4-propylphenyl)propyl]piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-[2-methyl-1-(4-propylphenyl)propyl]piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-[2-methyl-1-(4-propylphenyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-[2-methyl-1-(4-propylphenyl)propyl]piperidine-4-carboxamide Traditional Name: 1-esyl-N-[2-methyl-1-(4-propylphenyl)propyl]isonipecotamide Formula: C21H34N2O3S MolecularWeight: 394.57126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CC

InChI

InChI=1S/C21H34N2O3S/c1-5-7-17-8-10-18(11-9-17)20(16(3)4)22-21(24)19-12-14-23(15-13-19)27(25,26)6-2/h8-11,16,19-20H,5-7,12-15H2,1-4H3,(H,22,24)