N-(4-butylphenyl)-2-methylsulfonyl-benzamide

Systemtic Name: N-(4-butylphenyl)-2-methylsulfonyl-benzamide Openeye Name: N-(4-butylphenyl)-2-methylsulfonyl-benzamide CAS Name: N-(4-butylphenyl)-2-methylsulfonylbenzamide IUPAC Name: N-(4-butylphenyl)-2-methylsulfonylbenzamide Traditional Name: N-(4-butylphenyl)-2-mesyl-benzamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C18H21NO3S/c1-3-4-7-14-10-12-15(13-11-14)19-18(20)16-8-5-6-9-17(16)23(2,21)22/h5-6,8-13H,3-4,7H2,1-2H3,(H,19,20)