2-(azocan-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(azocan-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(azocan-1-yl)-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(1-azocanyl)-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(azocan-1-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(azocan-1-yl)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3CCCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3CCCCCCC3

InChI

InChI=1S/C21H33N3O4S/c1-28-20-11-10-18(29(26,27)24-14-8-5-9-15-24)16-19(20)22-21(25)17-23-12-6-3-2-4-7-13-23/h10-11,16H,2-9,12-15,17H2,1H3,(H,22,25)