3-[2-[(4-methyl-2-phenyl-pentanoyl)amino]-4-phenoxy-phenyl]propanoic acid

Systemtic Name: 3-[2-[(4-methyl-2-phenyl-pentanoyl)amino]-4-phenoxy-phenyl]propanoic acid Openeye Name: 3-[2-[(4-methyl-2-phenyl-pentanoyl)amino]-4-phenoxy-phenyl]propanoic acid CAS Name: 3-[2-[(4-methyl-1-oxo-2-phenylpentyl)amino]-4-phenoxyphenyl]propanoic acid IUPAC Name: 3-[2-[(4-methyl-2-phenylpentanoyl)amino]-4-phenoxyphenyl]propanoic acid Traditional Name: 3-[2-[(4-methyl-2-phenyl-pentanoyl)amino]-4-phenoxy-phenyl]propionic acid Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)OC3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)C(=O)NC2=C(C=CC(=C2)OC3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C27H29NO4/c1-19(2)17-24(20-9-5-3-6-10-20)27(31)28-25-18-23(32-22-11-7-4-8-12-22)15-13-21(25)14-16-26(29)30/h3-13,15,18-19,24H,14,16-17H2,1-2H3,(H,28,31)(H,29,30)