2-[[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(phenoxymethyl)phenyl]methoxy]ethanoic acid

Systemtic Name: 2-[[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(phenoxymethyl)phenyl]methoxy]ethanoic acid Openeye Name: 2-[[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(phenoxymethyl)phenyl]methoxy]acetic acid CAS Name: 2-[[2-[[(3-methyl-1-phenylbutyl)amino]-oxomethyl]-4-(phenoxymethyl)phenyl]methoxy]acetic acid IUPAC Name: 2-[[2-[(3-methyl-1-phenylbutyl)carbamoyl]-4-(phenoxymethyl)phenyl]methoxy]acetic acid Traditional Name: 2-[2-[(3-methyl-1-phenyl-butyl)carbamoyl]-4-(phenoxymethyl)benzyl]oxyacetic acid Formula: C28H31NO5 MolecularWeight: 461.54944

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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=C3)COCC(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)COC3=CC=CC=C3)COCC(=O)O

InChI

InChI=1S/C28H31NO5/c1-20(2)15-26(22-9-5-3-6-10-22)29-28(32)25-16-21(17-34-24-11-7-4-8-12-24)13-14-23(25)18-33-19-27(30)31/h3-14,16,20,26H,15,17-19H2,1-2H3,(H,29,32)(H,30,31)