2-methyl-5-(2-oxidanylidenechromen-3-yl)benzoate

Systemtic Name: 2-methyl-5-(2-oxidanylidenechromen-3-yl)benzoate Openeye Name: 2-methyl-5-(2-oxochromen-3-yl)benzoate CAS Name: 2-methyl-5-(2-oxo-1-benzopyran-3-yl)benzoate IUPAC Name: 2-methyl-5-(2-oxochromen-3-yl)benzoate Traditional Name: 5-(2-ketochromen-3-yl)-2-methyl-benzoate Formula: C17H11O4- MolecularWeight: 279.26684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3=CC=CC=C3OC2=O)C(=O)[O-]

InChI

InChI=1S/C17H12O4/c1-10-6-7-11(8-13(10)16(18)19)14-9-12-4-2-3-5-15(12)21-17(14)20/h2-9H,1H3,(H,18,19)/p-1