4-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenoxy-phenyl]butanoic acid

Systemtic Name: 4-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenoxy-phenyl]butanoic acid Openeye Name: 4-[2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]-4-phenoxy-phenyl]butanoic acid CAS Name: 4-[2-[[[4-(3,5-dimethylphenyl)-4-oxanyl]amino]-oxomethyl]-4-phenoxyphenyl]butanoic acid IUPAC Name: 4-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenoxyphenyl]butanoic acid Traditional Name: 4-[2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]-4-phenoxy-phenyl]butyric acid Formula: C30H33NO5 MolecularWeight: 487.58672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2(CCOCC2)NC(=O)C3=C(C=CC(=C3)OC4=CC=CC=C4)CCCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2(CCOCC2)NC(=O)C3=C(C=CC(=C3)OC4=CC=CC=C4)CCCC(=O)O)C

InChI

InChI=1S/C30H33NO5/c1-21-17-22(2)19-24(18-21)30(13-15-35-16-14-30)31-29(34)27-20-26(36-25-8-4-3-5-9-25)12-11-23(27)7-6-10-28(32)33/h3-5,8-9,11-12,17-20H,6-7,10,13-16H2,1-2H3,(H,31,34)(H,32,33)