3-[4-[(2-methoxyphenoxy)methyl]-2-[(3-methyl-1-phenyl-butyl)carbamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(2-methoxyphenoxy)methyl]-2-[(3-methyl-1-phenyl-butyl)carbamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(2-methoxyphenoxy)methyl]-2-[(3-methyl-1-phenyl-butyl)carbamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(2-methoxyphenoxy)methyl]-2-[[(3-methyl-1-phenylbutyl)amino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-methoxyphenoxy)methyl]-2-[(3-methyl-1-phenylbutyl)carbamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(2-methoxyphenoxy)methyl]-2-[(3-methyl-1-phenyl-butyl)carbamoyl]phenyl]propionic acid Formula: C29H33NO5 MolecularWeight: 475.57602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)COC3=CC=CC=C3OC)CCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)COC3=CC=CC=C3OC)CCC(=O)O

InChI

InChI=1S/C29H33NO5/c1-20(2)17-25(23-9-5-4-6-10-23)30-29(33)24-18-21(13-14-22(24)15-16-28(31)32)19-35-27-12-8-7-11-26(27)34-3/h4-14,18,20,25H,15-17,19H2,1-3H3,(H,30,33)(H,31,32)