(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-(3-methylbutoxy)benzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-(3-methylbutoxy)benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 4-isopentyloxybenzoate CAS Name: 4-(3-methylbutoxy)benzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxybenzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C26H30O5 MolecularWeight: 422.5134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)OCCC(C)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)OCCC(C)C)C(C)C

InChI

InChI=1S/C26H30O5/c1-16(2)10-11-29-21-8-6-19(7-9-21)26(28)30-15-20-13-25(27)31-24-12-18(5)22(17(3)4)14-23(20)24/h6-9,12-14,16-17H,10-11,15H2,1-5H3