3-[4-[(3,5-dimethylphenyl)methoxy]-2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(3,5-dimethylphenyl)methoxy]-2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(3,5-dimethylphenyl)methoxy]-2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(3,5-dimethylphenyl)methoxy]-2-[[[1-(3,5-dimethylphenyl)-3-methylbutyl]amino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(3,5-dimethylphenyl)methoxy]-2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]phenyl]propanoic acid Traditional Name: 3-[4-(3,5-dimethylbenzyl)oxy-2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]phenyl]propionic acid Formula: C32H39NO4 MolecularWeight: 501.65636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(CC(C)C)C3=CC(=CC(=C3)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(CC(C)C)C3=CC(=CC(=C3)C)C)C

InChI

InChI=1S/C32H39NO4/c1-20(2)11-30(27-16-23(5)13-24(6)17-27)33-32(36)29-18-28(9-7-26(29)8-10-31(34)35)37-19-25-14-21(3)12-22(4)15-25/h7,9,12-18,20,30H,8,10-11,19H2,1-6H3,(H,33,36)(H,34,35)