2-[3-[[(4-cyclohexylphenyl)methyl-methylsulfonyl-amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[(4-cyclohexylphenyl)methyl-methylsulfonyl-amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[(4-cyclohexylphenyl)methyl-methylsulfonyl-amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[(4-cyclohexylphenyl)methyl-methylsulfonylamino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[(4-cyclohexylphenyl)methyl-methylsulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[(4-cyclohexylbenzyl)-mesyl-amino]methyl]phenyl]acetic acid Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C2CCCCC2)CC3=CC=CC(=C3)CC(=O)O

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C2CCCCC2)CC3=CC=CC(=C3)CC(=O)O

InChI

InChI=1S/C23H29NO4S/c1-29(27,28)24(17-20-7-5-6-19(14-20)15-23(25)26)16-18-10-12-22(13-11-18)21-8-3-2-4-9-21/h5-7,10-14,21H,2-4,8-9,15-17H2,1H3,(H,25,26)