4-[7-(dimethylcarbamoyloxy)-4-oxidanylidene-chromen-3-yl]oxy-2-ethyl-benzoic acid

Systemtic Name: 4-[7-(dimethylcarbamoyloxy)-4-oxidanylidene-chromen-3-yl]oxy-2-ethyl-benzoic acid Openeye Name: 4-[7-(dimethylcarbamoyloxy)-4-oxo-chromen-3-yl]oxy-2-ethyl-benzoic acid CAS Name: 4-[[7-[dimethylamino(oxo)methoxy]-4-oxo-1-benzopyran-3-yl]oxy]-2-ethylbenzoic acid IUPAC Name: 4-[7-(dimethylcarbamoyloxy)-4-oxochromen-3-yl]oxy-2-ethylbenzoic acid Traditional Name: 4-[7-(dimethylcarbamoyloxy)-4-keto-chromen-3-yl]oxy-2-ethyl-benzoic acid Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)N(C)C)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)N(C)C)C(=O)O

InChI

InChI=1S/C21H19NO7/c1-4-12-9-13(5-7-15(12)20(24)25)28-18-11-27-17-10-14(29-21(26)22(2)3)6-8-16(17)19(18)23/h5-11H,4H2,1-3H3,(H,24,25)