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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)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 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H32O6 MolecularWeight: 452.53938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C)OCC(C)C

InChI

InChI=1S/C27H32O6/c1-7-30-25-11-19(8-9-23(25)31-14-16(2)3)27(29)32-15-20-12-26(28)33-24-10-18(6)21(17(4)5)13-22(20)24/h8-13,16-17H,7,14-15H2,1-6H3