N-(3,4-dipropoxyphenyl)-4-(methylsulfonylmethyl)benzamide

Systemtic Name: N-(3,4-dipropoxyphenyl)-4-(methylsulfonylmethyl)benzamide Openeye Name: N-(3,4-dipropoxyphenyl)-4-(methylsulfonylmethyl)benzamide CAS Name: N-(3,4-dipropoxyphenyl)-4-(methylsulfonylmethyl)benzamide IUPAC Name: N-(3,4-dipropoxyphenyl)-4-(methylsulfonylmethyl)benzamide Traditional Name: N-(3,4-dipropoxyphenyl)-4-(mesylmethyl)benzamide Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)OCCC

InChI

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