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

Systemtic Name: 7-butoxy-4-methyl-3-(2-oxidanylpropyl)chromen-2-one Openeye Name: 7-butoxy-3-(2-hydroxypropyl)-4-methyl-chromen-2-one CAS Name: 7-butoxy-3-(2-hydroxypropyl)-4-methyl-1-benzopyran-2-one IUPAC Name: 7-butoxy-3-(2-hydroxypropyl)-4-methylchromen-2-one Traditional Name: 7-butoxy-3-(2-hydroxypropyl)-4-methyl-coumarin Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O4/c1-4-5-8-20-13-6-7-14-12(3)15(9-11(2)18)17(19)21-16(14)10-13/h6-7,10-11,18H,4-5,8-9H2,1-3H3