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

Systemtic Name: 3-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenoxy-phenyl]propanoic acid Openeye Name: 3-[2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]-4-phenoxy-phenyl]propanoic acid CAS Name: 3-[2-[[[4-(3,5-dimethylphenyl)-4-oxanyl]amino]-oxomethyl]-4-phenoxyphenyl]propanoic acid IUPAC Name: 3-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenoxyphenyl]propanoic acid Traditional Name: 3-[2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]-4-phenoxy-phenyl]propionic acid Formula: C29H31NO5 MolecularWeight: 473.56014

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)CCC(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C29H31NO5/c1-20-16-21(2)18-23(17-20)29(12-14-34-15-13-29)30-28(33)26-19-25(35-24-6-4-3-5-7-24)10-8-22(26)9-11-27(31)32/h3-8,10,16-19H,9,11-15H2,1-2H3,(H,30,33)(H,31,32)