4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-4-oxidanylidene-2-phenethyl-butanoic acid

Systemtic Name: 4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-4-oxidanylidene-2-phenethyl-butanoic acid Openeye Name: 4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-4-oxo-2-phenethyl-butanoic acid CAS Name: 4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-4-oxo-2-phenethylbutanoic acid IUPAC Name: 4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-4-oxo-2-phenethylbutanoic acid Traditional Name: 4-keto-4-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-2-phenethyl-butyric acid Formula: C32H28N2O4 MolecularWeight: 504.57572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)CC(CCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)CC(CCC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C32H28N2O4/c1-21-7-18-30-28(19-21)34-32(38-30)33-27-16-14-24(15-17-27)23-10-12-25(13-11-23)29(35)20-26(31(36)37)9-8-22-5-3-2-4-6-22/h2-7,10-19,26H,8-9,20H2,1H3,(H,33,34)(H,36,37)