2-[4-chloranyl-3-[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethyl-phenyl]carbonylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-chloranyl-3-[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethyl-phenyl]carbonylamino]phenyl]ethanoic acid Openeye Name: 2-[4-chloro-3-[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethyl-benzoyl]amino]phenyl]acetic acid CAS Name: 2-[4-chloro-3-[[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethylphenyl]-oxomethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-chloro-3-[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethylbenzoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-chloro-3-[[4-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methoxy]-2,6-dimethyl-benzoyl]amino]phenyl]acetic acid Formula: C26H25ClN2O5 MolecularWeight: 480.9401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)NC2=C(C=CC(=C2)CC(=O)O)Cl)C)OCC3CNC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)NC2=C(C=CC(=C2)CC(=O)O)Cl)C)OC[C@H]3CNC4=CC=CC=C4O3

InChI

InChI=1S/C26H25ClN2O5/c1-15-9-18(33-14-19-13-28-21-5-3-4-6-23(21)34-19)10-16(2)25(15)26(32)29-22-11-17(12-24(30)31)7-8-20(22)27/h3-11,19,28H,12-14H2,1-2H3,(H,29,32)(H,30,31)/t19-/m1/s1