4-[(E)-2-[8-(carboxymethyl)-7-methoxy-3-methyl-4-oxidanylidene-chromen-2-yl]ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-[8-(carboxymethyl)-7-methoxy-3-methyl-4-oxidanylidene-chromen-2-yl]ethenyl]benzoic acid Openeye Name: 4-[(E)-2-[8-(carboxymethyl)-7-methoxy-3-methyl-4-oxo-chromen-2-yl]vinyl]benzoic acid CAS Name: 4-[(E)-2-[8-(carboxymethyl)-7-methoxy-3-methyl-4-oxo-1-benzopyran-2-yl]ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-[8-(carboxymethyl)-7-methoxy-3-methyl-4-oxochromen-2-yl]ethenyl]benzoic acid Traditional Name: 4-[(E)-2-[8-(carboxymethyl)-4-keto-7-methoxy-3-methyl-chromen-2-yl]vinyl]benzoic acid Formula: C22H18O7 MolecularWeight: 394.37412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC(=C2CC(=O)O)OC)C=CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC(=C2CC(=O)O)OC)/C=C/C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H18O7/c1-12-17(9-5-13-3-6-14(7-4-13)22(26)27)29-21-15(20(12)25)8-10-18(28-2)16(21)11-19(23)24/h3-10H,11H2,1-2H3,(H,23,24)(H,26,27)/b9-5+