3-cyano-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 3-cyano-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 3-cyano-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 3-cyano-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-cyano-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-cyano-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H23N3O4S/c1-2-28-20-10-9-18(29(26,27)24-11-4-3-5-12-24)14-19(20)23-21(25)17-8-6-7-16(13-17)15-22/h6-10,13-14H,2-5,11-12H2,1H3,(H,23,25)