2-[4-[3-fluoranyl-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylate

Systemtic Name: 2-[4-[3-fluoranyl-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]carbonylcyclopentane-1-carboxylate Openeye Name: 2-[4-[3-fluoro-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylate CAS Name: 2-[[4-[3-fluoro-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]phenyl]-oxomethyl]-1-cyclopentanecarboxylate IUPAC Name: 2-[4-[3-fluoro-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentane-1-carboxylate Traditional Name: 2-[4-[3-fluoro-4-[(6-methyl-1,3-benzoxazol-2-yl)amino]phenyl]benzoyl]cyclopentanecarboxylate Formula: C27H22FN2O4- MolecularWeight: 457.472983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)NC3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)[O-])F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)NC3=C(C=C(C=C3)C4=CC=C(C=C4)C(=O)C5CCCC5C(=O)[O-])F

InChI

InChI=1S/C27H23FN2O4/c1-15-5-11-23-24(13-15)34-27(30-23)29-22-12-10-18(14-21(22)28)16-6-8-17(9-7-16)25(31)19-3-2-4-20(19)26(32)33/h5-14,19-20H,2-4H2,1H3,(H,29,30)(H,32,33)/p-1