2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamoyl]phenyl]benzoic acid Openeye Name: 2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)anilino]-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamoyl]phenyl]benzoic acid Formula: C28H20N2O4 MolecularWeight: 448.4694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5C(=O)O

InChI

InChI=1S/C28H20N2O4/c1-17-13-14-25-24(15-17)30-27(34-25)18-7-6-8-19(16-18)29-26(31)22-11-4-2-9-20(22)21-10-3-5-12-23(21)28(32)33/h2-16H,1H3,(H,29,31)(H,32,33)