2-(2-chloranyl-4-piperidin-1-ylsulfonyl-phenoxy)-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-piperidin-1-ylsulfonyl-phenoxy)-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[2-chloro-4-(1-piperidylsulfonyl)phenoxy]-N-(p-tolylmethyl)acetamide CAS Name: 2-[2-chloro-4-(1-piperidinylsulfonyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-(2-chloro-4-piperidin-1-ylsulfonylphenoxy)-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-(2-chloro-4-piperidinosulfonyl-phenoxy)-N-(4-methylbenzyl)acetamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-16-5-7-17(8-6-16)14-23-21(25)15-28-20-10-9-18(13-19(20)22)29(26,27)24-11-3-2-4-12-24/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,23,25)