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

Systemtic Name: 4-methyl-3-(3-methylbutyl)-7-(2-oxidanylidenepropoxy)chromen-2-one Openeye Name: 7-acetonyloxy-3-isopentyl-4-methyl-chromen-2-one CAS Name: 4-methyl-3-(3-methylbutyl)-7-(2-oxopropoxy)-1-benzopyran-2-one IUPAC Name: 4-methyl-3-(3-methylbutyl)-7-(2-oxopropoxy)chromen-2-one Traditional Name: 7-acetonyloxy-3-isoamyl-4-methyl-coumarin Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O4/c1-11(2)5-7-16-13(4)15-8-6-14(21-10-12(3)19)9-17(15)22-18(16)20/h6,8-9,11H,5,7,10H2,1-4H3