4-methyl-7-(5-methyl-2-oxidanylidene-cyclohexyl)oxy-chromen-2-one

Systemtic Name: 4-methyl-7-(5-methyl-2-oxidanylidene-cyclohexyl)oxy-chromen-2-one Openeye Name: 4-methyl-7-(5-methyl-2-oxo-cyclohexoxy)chromen-2-one CAS Name: 4-methyl-7-(5-methyl-2-oxocyclohexyl)oxy-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(5-methyl-2-oxocyclohexyl)oxychromen-2-one Traditional Name: 7-(2-keto-5-methyl-cyclohexoxy)-4-methyl-coumarin Formula: C17H18O4 MolecularWeight: 286.32242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C(C1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CC1CCC(=O)C(C1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C17H18O4/c1-10-3-6-14(18)16(7-10)20-12-4-5-13-11(2)8-17(19)21-15(13)9-12/h4-5,8-10,16H,3,6-7H2,1-2H3