ethyl 3-methyl-4-oxidanylidene-2-(4-pentylphenyl)chromene-8-carboxylate

Systemtic Name: ethyl 3-methyl-4-oxidanylidene-2-(4-pentylphenyl)chromene-8-carboxylate Openeye Name: ethyl 3-methyl-4-oxo-2-(4-pentylphenyl)chromene-8-carboxylate CAS Name: 3-methyl-4-oxo-2-(4-pentylphenyl)-1-benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-oxo-2-(4-pentylphenyl)chromene-8-carboxylate Traditional Name: 2-(4-amylphenyl)-4-keto-3-methyl-chromene-8-carboxylic acid ethyl ester Formula: C24H26O4 MolecularWeight: 378.46084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C(=CC=C3)C(=O)OCC)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C(=CC=C3)C(=O)OCC)C

InChI

InChI=1S/C24H26O4/c1-4-6-7-9-17-12-14-18(15-13-17)22-16(3)21(25)19-10-8-11-20(23(19)28-22)24(26)27-5-2/h8,10-15H,4-7,9H2,1-3H3