N-[1-(4-butoxyphenyl)ethyl]-3-[(3-chlorophenyl)methylsulfonyl]propanamide

Systemtic Name: N-[1-(4-butoxyphenyl)ethyl]-3-[(3-chlorophenyl)methylsulfonyl]propanamide Openeye Name: N-[1-(4-butoxyphenyl)ethyl]-3-[(3-chlorophenyl)methylsulfonyl]propanamide CAS Name: N-[1-(4-butoxyphenyl)ethyl]-3-[(3-chlorophenyl)methylsulfonyl]propanamide IUPAC Name: N-[1-(4-butoxyphenyl)ethyl]-3-[(3-chlorophenyl)methylsulfonyl]propanamide Traditional Name: N-[1-(4-butoxyphenyl)ethyl]-3-(3-chlorobenzyl)sulfonyl-propionamide Formula: C22H28ClNO4S MolecularWeight: 437.98002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)NC(=O)CCS(=O)(=O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C)NC(=O)CCS(=O)(=O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C22H28ClNO4S/c1-3-4-13-28-21-10-8-19(9-11-21)17(2)24-22(25)12-14-29(26,27)16-18-6-5-7-20(23)15-18/h5-11,15,17H,3-4,12-14,16H2,1-2H3,(H,24,25)