methyl 7-(4-tert-butylphenoxy)-2-ethanoyl-heptanoate

Systemtic Name: methyl 7-(4-tert-butylphenoxy)-2-ethanoyl-heptanoate Openeye Name: methyl 2-acetyl-7-(4-tert-butylphenoxy)heptanoate CAS Name: 2-acetyl-7-(4-tert-butylphenoxy)heptanoic acid methyl ester IUPAC Name: methyl 2-acetyl-7-(4-tert-butylphenoxy)heptanoate Traditional Name: 2-acetyl-7-(4-tert-butylphenoxy)enanthic acid methyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCCOC1=CC=C(C=C1)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC(=O)C(CCCCCOC1=CC=C(C=C1)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C20H30O4/c1-15(21)18(19(22)23-5)9-7-6-8-14-24-17-12-10-16(11-13-17)20(2,3)4/h10-13,18H,6-9,14H2,1-5H3