7-butoxy-4-methyl-3-(2-methylpropyl)chromen-2-one

Systemtic Name: 7-butoxy-4-methyl-3-(2-methylpropyl)chromen-2-one Openeye Name: 7-butoxy-3-isobutyl-4-methyl-chromen-2-one CAS Name: 7-butoxy-4-methyl-3-(2-methylpropyl)-1-benzopyran-2-one IUPAC Name: 7-butoxy-4-methyl-3-(2-methylpropyl)chromen-2-one Traditional Name: 7-butoxy-3-isobutyl-4-methyl-coumarin Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CC(C)C)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CC(C)C)C

InChI

InChI=1S/C18H24O3/c1-5-6-9-20-14-7-8-15-13(4)16(10-12(2)3)18(19)21-17(15)11-14/h7-8,11-12H,5-6,9-10H2,1-4H3