N-[4-methoxy-3-(phenylmethyl)phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[4-methoxy-3-(phenylmethyl)phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-(3-benzyl-4-methoxy-phenyl)-3-methylsulfonyl-benzamide CAS Name: N-[4-methoxy-3-(phenylmethyl)phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-(3-benzyl-4-methoxyphenyl)-3-methylsulfonylbenzamide Traditional Name: N-(3-benzyl-4-methoxy-phenyl)-3-mesyl-benzamide Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C22H21NO4S/c1-27-21-12-11-19(14-18(21)13-16-7-4-3-5-8-16)23-22(24)17-9-6-10-20(15-17)28(2,25)26/h3-12,14-15H,13H2,1-2H3,(H,23,24)