2-[[7-(2,2-dimethylpropanoyloxy)-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-2-yl]methoxy]ethanoic acid

Systemtic Name: 2-[[7-(2,2-dimethylpropanoyloxy)-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-2-yl]methoxy]ethanoic acid Openeye Name: 2-[[7-(2,2-dimethylpropanoyloxy)-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxo-chromen-2-yl]methoxy]acetic acid CAS Name: 2-[[7-(2,2-dimethyl-1-oxopropoxy)-6-ethyl-3-(1-methyl-2-benzimidazolyl)-4-oxo-1-benzopyran-2-yl]methoxy]acetic acid IUPAC Name: 2-[[7-(2,2-dimethylpropanoyloxy)-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-2-yl]methoxy]acetic acid Traditional Name: 2-[[6-ethyl-4-keto-3-(1-methylbenzimidazol-2-yl)-7-pivaloyloxy-chromen-2-yl]methoxy]acetic acid Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)COCC(=O)O)C3=NC4=CC=CC=C4N3C)OC(=O)C(C)(C)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)COCC(=O)O)C3=NC4=CC=CC=C4N3C)OC(=O)C(C)(C)C

InChI

InChI=1S/C27H28N2O7/c1-6-15-11-16-20(12-19(15)36-26(33)27(2,3)4)35-21(13-34-14-22(30)31)23(24(16)32)25-28-17-9-7-8-10-18(17)29(25)5/h7-12H,6,13-14H2,1-5H3,(H,30,31)