2-[[2-(2-methylphenyl)-4-[1-(3-propan-2-ylphenyl)pentoxymethyl]phenyl]carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[[2-(2-methylphenyl)-4-[1-(3-propan-2-ylphenyl)pentoxymethyl]phenyl]carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[[4-[1-(3-isopropylphenyl)pentoxymethyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[[2-(2-methylphenyl)-4-[1-(3-propan-2-ylphenyl)pentoxymethyl]phenyl]-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[[2-(2-methylphenyl)-4-[1-(3-propan-2-ylphenyl)pentoxymethyl]benzoyl]amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[[4-(1-m-cumenylpentoxymethyl)-2-(o-tolyl)benzoyl]amino]-4-mesyl-butyric acid Formula: C34H43NO6S MolecularWeight: 593.77332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC(=C1)C(C)C)OCC2=CC(=C(C=C2)C(=O)NC(CCS(=O)(=O)C)C(=O)O)C3=CC=CC=C3C

Isomeric SMILES

CCCCC(C1=CC=CC(=C1)C(C)C)OCC2=CC(=C(C=C2)C(=O)NC(CCS(=O)(=O)C)C(=O)O)C3=CC=CC=C3C

InChI

InChI=1S/C34H43NO6S/c1-6-7-15-32(27-13-10-12-26(21-27)23(2)3)41-22-25-16-17-29(30(20-25)28-14-9-8-11-24(28)4)33(36)35-31(34(37)38)18-19-42(5,39)40/h8-14,16-17,20-21,23,31-32H,6-7,15,18-19,22H2,1-5H3,(H,35,36)(H,37,38)