3-butyl-7-ethoxy-4-methyl-chromen-2-one

Systemtic Name: 3-butyl-7-ethoxy-4-methyl-chromen-2-one Openeye Name: 3-butyl-7-ethoxy-4-methyl-chromen-2-one CAS Name: 3-butyl-7-ethoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-butyl-7-ethoxy-4-methylchromen-2-one Traditional Name: 3-butyl-7-ethoxy-4-methyl-coumarin Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C=C(C=C2)OCC)OC1=O)C

Isomeric SMILES

CCCCC1=C(C2=C(C=C(C=C2)OCC)OC1=O)C

InChI

InChI=1S/C16H20O3/c1-4-6-7-14-11(3)13-9-8-12(18-5-2)10-15(13)19-16(14)17/h8-10H,4-7H2,1-3H3