N-[3-(4-ethoxy-3-methoxy-phenyl)propyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(4-ethoxy-3-methoxy-phenyl)propyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[3-(4-ethoxy-3-methoxy-phenyl)propyl]-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(4-ethoxy-3-methoxyphenyl)propyl]-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(4-ethoxy-3-methoxyphenyl)propyl]-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[3-(4-ethoxy-3-methoxy-phenyl)propyl]-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C26H36N2O5S MolecularWeight: 488.63944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3C)OC

InChI

InChI=1S/C26H36N2O5S/c1-4-33-24-12-11-21(18-25(24)32-3)9-7-15-27-26(29)22-13-16-28(17-14-22)34(30,31)19-23-10-6-5-8-20(23)2/h5-6,8,10-12,18,22H,4,7,9,13-17,19H2,1-3H3,(H,27,29)