2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]carbonylcyclohexane-1-carboxylic acid

Systemtic Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]carbonylcyclohexane-1-carboxylic acid Openeye Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclohexanecarboxylic acid CAS Name: 2-[[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclohexanecarboxylic acid Formula: C28H26N2O4 MolecularWeight: 454.51704

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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)C5CCCCC5C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCCC5C(=O)O

InChI

InChI=1S/C28H26N2O4/c1-17-6-15-25-24(16-17)30-28(34-25)29-21-13-11-19(12-14-21)18-7-9-20(10-8-18)26(31)22-4-2-3-5-23(22)27(32)33/h6-16,22-23H,2-5H2,1H3,(H,29,30)(H,32,33)