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

Systemtic Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]-3-(methylsulfonylmethyl)benzamide Openeye Name: N-[(3-methoxy-4-propoxy-phenyl)methyl]-3-(methylsulfonylmethyl)benzamide CAS Name: N-[(3-methoxy-4-propoxyphenyl)methyl]-3-(methylsulfonylmethyl)benzamide IUPAC Name: N-[(3-methoxy-4-propoxyphenyl)methyl]-3-(methylsulfonylmethyl)benzamide Traditional Name: 3-(mesylmethyl)-N-(3-methoxy-4-propoxy-benzyl)benzamide Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C)OC

InChI

InChI=1S/C20H25NO5S/c1-4-10-26-18-9-8-15(12-19(18)25-2)13-21-20(22)17-7-5-6-16(11-17)14-27(3,23)24/h5-9,11-12H,4,10,13-14H2,1-3H3,(H,21,22)