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

Systemtic Name: 3-[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(1-phenoxyethyl)phenyl]propanoic acid Openeye Name: 3-[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(1-phenoxyethyl)phenyl]propanoic acid CAS Name: 3-[2-[[(3-methyl-1-phenylbutyl)amino]-oxomethyl]-4-(1-phenoxyethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(3-methyl-1-phenylbutyl)carbamoyl]-4-(1-phenoxyethyl)phenyl]propanoic acid Traditional Name: 3-[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(1-phenoxyethyl)phenyl]propionic acid Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)C(C)OC3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)C(C)OC3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C29H33NO4/c1-20(2)18-27(23-10-6-4-7-11-23)30-29(33)26-19-24(15-14-22(26)16-17-28(31)32)21(3)34-25-12-8-5-9-13-25/h4-15,19-21,27H,16-18H2,1-3H3,(H,30,33)(H,31,32)