4-butyl-3-ethyl-5-oxidanyl-chromen-2-one

Systemtic Name: 4-butyl-3-ethyl-5-oxidanyl-chromen-2-one Openeye Name: 4-butyl-3-ethyl-5-hydroxy-chromen-2-one CAS Name: 4-butyl-3-ethyl-5-hydroxy-1-benzopyran-2-one IUPAC Name: 4-butyl-3-ethyl-5-hydroxychromen-2-one Traditional Name: 4-butyl-3-ethyl-5-hydroxy-coumarin Formula: C15H18O3 MolecularWeight: 246.30162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)OC2=C1C(=CC=C2)O)CC

Isomeric SMILES

CCCCC1=C(C(=O)OC2=C1C(=CC=C2)O)CC

InChI

InChI=1S/C15H18O3/c1-3-5-7-11-10(4-2)15(17)18-13-9-6-8-12(16)14(11)13/h6,8-9,16H,3-5,7H2,1-2H3