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

Systemtic Name: 4-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butanoic acid Openeye Name: 4-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butanoic acid CAS Name: 4-[2-[[[1-(3,5-dimethylphenyl)-3-methylbutyl]amino]-oxomethyl]-4-phenoxyphenyl]butanoic acid IUPAC Name: 4-[2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-4-phenoxyphenyl]butanoic acid Traditional Name: 4-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-phenoxy-phenyl]butyric acid Formula: C30H35NO4 MolecularWeight: 473.6032

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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)CCCC(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C30H35NO4/c1-20(2)15-28(24-17-21(3)16-22(4)18-24)31-30(34)27-19-26(35-25-10-6-5-7-11-25)14-13-23(27)9-8-12-29(32)33/h5-7,10-11,13-14,16-20,28H,8-9,12,15H2,1-4H3,(H,31,34)(H,32,33)