N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(methylsulfonylmethyl)benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(methylsulfonylmethyl)benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(methylsulfonylmethyl)benzamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-3-(methylsulfonylmethyl)benzamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-3-(mesylmethyl)benzamide Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)OC

InChI

InChI=1S/C21H27NO5S/c1-4-5-11-27-19-10-9-16(13-20(19)26-2)14-22-21(23)18-8-6-7-17(12-18)15-28(3,24)25/h6-10,12-13H,4-5,11,14-15H2,1-3H3,(H,22,23)