N-[(2S)-5-methylhexan-2-yl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[(2S)-5-methylhexan-2-yl]-4-methylsulfonyl-benzamide Openeye Name: N-[(1S)-1,4-dimethylpentyl]-4-methylsulfonyl-benzamide CAS Name: N-[(2S)-5-methylhexan-2-yl]-4-methylsulfonylbenzamide IUPAC Name: N-[(2S)-5-methylhexan-2-yl]-4-methylsulfonylbenzamide Traditional Name: N-[(1S)-1,4-dimethylpentyl]-4-mesyl-benzamide Formula: C15H23NO3S MolecularWeight: 297.41302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C15H23NO3S/c1-11(2)5-6-12(3)16-15(17)13-7-9-14(10-8-13)20(4,18)19/h7-12H,5-6H2,1-4H3,(H,16,17)/t12-/m0/s1