3-butyl-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxidanylidene-chromene-6-carboxylic acid

Systemtic Name: 3-butyl-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxidanylidene-chromene-6-carboxylic acid Openeye Name: 3-butyl-2-[(E)-2-(o-tolyl)vinyl]-4-oxo-chromene-6-carboxylic acid CAS Name: 3-butyl-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxo-1-benzopyran-6-carboxylic acid IUPAC Name: 3-butyl-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxochromene-6-carboxylic acid Traditional Name: 3-butyl-4-keto-2-[(E)-2-(o-tolyl)vinyl]chromene-6-carboxylic acid Formula: C23H22O4 MolecularWeight: 362.41838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C=CC3=CC=CC=C3C

Isomeric SMILES

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)/C=C/C3=CC=CC=C3C

InChI

InChI=1S/C23H22O4/c1-3-4-9-18-20(12-10-16-8-6-5-7-15(16)2)27-21-13-11-17(23(25)26)14-19(21)22(18)24/h5-8,10-14H,3-4,9H2,1-2H3,(H,25,26)/b12-10+