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

Systemtic Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxidanylidene-3-propyl-chromene-6-carboxylic acid Openeye Name: 2-[(E)-2-(3-methoxyphenyl)vinyl]-4-oxo-3-propyl-chromene-6-carboxylic acid CAS Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxo-3-propyl-1-benzopyran-6-carboxylic acid IUPAC Name: 2-[(E)-2-(3-methoxyphenyl)ethenyl]-4-oxo-3-propylchromene-6-carboxylic acid Traditional Name: 4-keto-2-[(E)-2-(3-methoxyphenyl)vinyl]-3-propyl-chromene-6-carboxylic acid Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C=CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)/C=C/C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H20O5/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/h4,6-13H,3,5H2,1-2H3,(H,24,25)/b10-8+