4-cyano-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-cyano-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-cyano-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-cyano-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-cyano-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-cyano-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)N3CCCCC3

InChI

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