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

Systemtic Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-(3-methoxyphenoxy)phenyl]butanoic acid Openeye Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-(3-methoxyphenoxy)phenyl]butanoic acid CAS Name: 3-[2-[[[1-(3,5-dimethylphenyl)-3-methylbutyl]amino]-oxomethyl]-4-(3-methoxyphenoxy)phenyl]butanoic acid IUPAC Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-4-(3-methoxyphenoxy)phenyl]butanoic acid Traditional Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-(3-methoxyphenoxy)phenyl]butyric acid Formula: C31H37NO5 MolecularWeight: 503.62918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OC3=CC(=CC=C3)OC)C(C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OC3=CC(=CC=C3)OC)C(C)CC(=O)O)C

InChI

InChI=1S/C31H37NO5/c1-19(2)12-29(23-14-20(3)13-21(4)15-23)32-31(35)28-18-26(10-11-27(28)22(5)16-30(33)34)37-25-9-7-8-24(17-25)36-6/h7-11,13-15,17-19,22,29H,12,16H2,1-6H3,(H,32,35)(H,33,34)