N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[5-chloro-2-(4-ethoxyphenoxy)phenyl]-1-mesyl-nipecotamide Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)NC(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C21H25ClN2O5S/c1-3-28-17-7-9-18(10-8-17)29-20-11-6-16(22)13-19(20)23-21(25)15-5-4-12-24(14-15)30(2,26)27/h6-11,13,15H,3-5,12,14H2,1-2H3,(H,23,25)