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

Systemtic Name: 3-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenylmethoxy-phenyl]propanoic acid Openeye Name: 3-[4-benzyloxy-2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]phenyl]propanoic acid CAS Name: 3-[2-[[[4-(3,5-dimethylphenyl)-4-oxanyl]amino]-oxomethyl]-4-phenylmethoxyphenyl]propanoic acid IUPAC Name: 3-[2-[[4-(3,5-dimethylphenyl)oxan-4-yl]carbamoyl]-4-phenylmethoxyphenyl]propanoic acid Traditional Name: 3-[4-benzoxy-2-[[4-(3,5-dimethylphenyl)tetrahydropyran-4-yl]carbamoyl]phenyl]propionic acid Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2(CCOCC2)NC(=O)C3=C(C=CC(=C3)OCC4=CC=CC=C4)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2(CCOCC2)NC(=O)C3=C(C=CC(=C3)OCC4=CC=CC=C4)CCC(=O)O)C

InChI

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