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

Systemtic Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylic acid Openeye Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylic acid CAS Name: 2-[[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-oxomethyl]-1-cyclopentanecarboxylic acid IUPAC Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentane-1-carboxylic acid Traditional Name: 2-[4-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylic acid Formula: C27H24N2O4 MolecularWeight: 440.49046

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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)C5CCCC5C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)O

InChI

InChI=1S/C27H24N2O4/c1-16-5-14-24-23(15-16)29-27(33-24)28-20-12-10-18(11-13-20)17-6-8-19(9-7-17)25(30)21-3-2-4-22(21)26(31)32/h5-15,21-22H,2-4H2,1H3,(H,28,29)(H,31,32)