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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)COCC3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)COCC3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C29H33NO4/c1-21(2)17-27(25-11-7-4-8-12-25)30-29(33)26-18-23(13-14-24(26)15-16-28(31)32)20-34-19-22-9-5-3-6-10-22/h3-14,18,21,27H,15-17,19-20H2,1-2H3,(H,30,33)(H,31,32)