3-(4-methylcyclohexyl)carbonyl-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-(4-methylcyclohexyl)carbonyl-4-oxidanylidene-chromen-2-olate Openeye Name: 3-(4-methylcyclohexanecarbonyl)-4-oxo-chromen-2-olate CAS Name: 3-[(4-methylcyclohexyl)-oxomethyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-(4-methylcyclohexanecarbonyl)-4-oxochromen-2-olate Traditional Name: 4-keto-3-(4-methylcyclohexanecarbonyl)chromen-2-olate Formula: C17H17O4- MolecularWeight: 285.31448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)C2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

CC1CCC(CC1)C(=O)C2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C17H18O4/c1-10-6-8-11(9-7-10)15(18)14-16(19)12-4-2-3-5-13(12)21-17(14)20/h2-5,10-11,20H,6-9H2,1H3/p-1