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7-butanoyl-8-(3-methylbutyl)chromen-2-one

7-butanoyl-8-(3-methylbutyl)chromen-2-one

Systemtic Name:7-butanoyl-8-(3-methylbutyl)chromen-2-one
Openeye Name:7-butanoyl-8-isopentyl-chromen-2-one
CAS Name:8-(3-methylbutyl)-7-(1-oxobutyl)-1-benzopyran-2-one
IUPAC Name:7-butanoyl-8-(3-methylbutyl)chromen-2-one
Traditional Name:7-butyryl-8-isoamyl-coumarin
Formula: C18H22O3
MolecularWeight: 286.36548
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C2=C(C=C1)C=CC(=O)O2)CCC(C)C


Isomeric SMILES

CCCC(=O)C1=C(C2=C(C=C1)C=CC(=O)O2)CCC(C)C


InChI

InChI=1S/C18H22O3/c1-4-5-16(19)14-10-7-13-8-11-17(20)21-18(13)15(14)9-6-12(2)3/h7-8,10-12H,4-6,9H2,1-3H3


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