2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxidanylidene-3-prop-2-enyl-chromene-6-carboxylic acid

Systemtic Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxidanylidene-3-prop-2-enyl-chromene-6-carboxylic acid Openeye Name: 3-allyl-2-[(E)-2-(3-methoxyphenyl)vinyl]-4-oxo-chromene-6-carboxylic acid CAS Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxo-3-prop-2-enyl-1-benzopyran-6-carboxylic acid IUPAC Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxo-3-prop-2-enylchromene-6-carboxylic acid Traditional Name: 3-allyl-4-keto-2-[(E)-2-(3-methoxyphenyl)vinyl]chromene-6-carboxylic acid Formula: C22H18O5 MolecularWeight: 362.37532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC2=C(C(=O)C3=C(O2)C=CC(=C3)C(=O)O)CC=C

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C2=C(C(=O)C3=C(O2)C=CC(=C3)C(=O)O)CC=C

InChI

InChI=1S/C22H18O5/c1-3-5-17-19(10-8-14-6-4-7-16(12-14)26-2)27-20-11-9-15(22(24)25)13-18(20)21(17)23/h3-4,6-13H,1,5H2,2H3,(H,24,25)/b10-8+