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

Systemtic Name: N-(3,4-dipropoxyphenyl)-4-methylsulfonyl-benzamide Openeye Name: N-(3,4-dipropoxyphenyl)-4-methylsulfonyl-benzamide CAS Name: N-(3,4-dipropoxyphenyl)-4-methylsulfonylbenzamide IUPAC Name: N-(3,4-dipropoxyphenyl)-4-methylsulfonylbenzamide Traditional Name: N-(3,4-dipropoxyphenyl)-4-mesyl-benzamide Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO5S/c1-4-12-25-18-11-8-16(14-19(18)26-13-5-2)21-20(22)15-6-9-17(10-7-15)27(3,23)24/h6-11,14H,4-5,12-13H2,1-3H3,(H,21,22)