(2S)-2-[(2-methyl-3-oxidanylidene-5,7-dipropyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-[(2-methyl-3-oxidanylidene-5,7-dipropyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-ethanoic acid Openeye Name: (2S)-2-[(2-methyl-3-oxo-5,7-dipropyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-acetic acid CAS Name: (2S)-2-[(2-methyl-3-oxo-5,7-dipropyl-1,2-benzoxazol-6-yl)oxy]-2-phenylacetic acid IUPAC Name: (2S)-2-[(2-methyl-3-oxo-5,7-dipropyl-1,2-benzoxazol-6-yl)oxy]-2-phenylacetic acid Traditional Name: (2S)-2-(3-keto-2-methyl-5,7-dipropyl-indoxazen-6-yl)oxy-2-phenyl-acetic acid Formula: C22H25NO5 MolecularWeight: 383.4376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=O)N(O2)C)CCC)OC(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=O)N(O2)C)CCC)O[C@@H](C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25NO5/c1-4-9-15-13-17-20(28-23(3)21(17)24)16(10-5-2)18(15)27-19(22(25)26)14-11-7-6-8-12-14/h6-8,11-13,19H,4-5,9-10H2,1-3H3,(H,25,26)/t19-/m0/s1