4-methyl-7-(3-methylbutoxy)-3-(3-methylbutyl)chromen-2-one

Systemtic Name: 4-methyl-7-(3-methylbutoxy)-3-(3-methylbutyl)chromen-2-one Openeye Name: 3-isopentyl-7-isopentyloxy-4-methyl-chromen-2-one CAS Name: 4-methyl-7-(3-methylbutoxy)-3-(3-methylbutyl)-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(3-methylbutoxy)-3-(3-methylbutyl)chromen-2-one Traditional Name: 7-isoamoxy-3-isoamyl-4-methyl-coumarin Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCCC(C)C)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCCC(C)C)CCC(C)C

InChI

InChI=1S/C20H28O3/c1-13(2)6-8-18-15(5)17-9-7-16(22-11-10-14(3)4)12-19(17)23-20(18)21/h7,9,12-14H,6,8,10-11H2,1-5H3