methylbenzene; 2-oxidanyl-3-(2-oxidanylidenepropyl)chromen-4-one

Systemtic Name: methylbenzene; 2-oxidanyl-3-(2-oxidanylidenepropyl)chromen-4-one Openeye Name: 3-acetonyl-2-hydroxy-chromen-4-one; toluene CAS Name: 2-hydroxy-3-(2-oxopropyl)-1-benzopyran-4-one; toluene IUPAC Name: 2-hydroxy-3-(2-oxopropyl)chromen-4-one; toluene Traditional Name: 3-acetonyl-2-hydroxy-chromone; toluene Formula: C19H18O4 MolecularWeight: 310.34382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC(=O)CC1=C(OC2=CC=CC=C2C1=O)O

Isomeric SMILES

CC1=CC=CC=C1.CC(=O)CC1=C(OC2=CC=CC=C2C1=O)O

InChI

InChI=1S/C12H10O4.C7H8/c1-7(13)6-9-11(14)8-4-2-3-5-10(8)16-12(9)15;1-7-5-3-2-4-6-7/h2-5,15H,6H2,1H3;2-6H,1H3