hexyl 2-(2,6-dimethoxyphenyl)carbonyl-4,6,6-trimethyl-heptanoate

Systemtic Name: hexyl 2-(2,6-dimethoxyphenyl)carbonyl-4,6,6-trimethyl-heptanoate Openeye Name: hexyl 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethyl-heptanoate CAS Name: 2-[(2,6-dimethoxyphenyl)-oxomethyl]-4,6,6-trimethylheptanoic acid hexyl ester IUPAC Name: hexyl 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethylheptanoate Traditional Name: 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethyl-enanthic acid hexyl ester Formula: C25H40O5 MolecularWeight: 420.5821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CC(C)CC(C)(C)C)C(=O)C1=C(C=CC=C1OC)OC

Isomeric SMILES

CCCCCCOC(=O)C(CC(C)CC(C)(C)C)C(=O)C1=C(C=CC=C1OC)OC

InChI

InChI=1S/C25H40O5/c1-8-9-10-11-15-30-24(27)19(16-18(2)17-25(3,4)5)23(26)22-20(28-6)13-12-14-21(22)29-7/h12-14,18-19H,8-11,15-17H2,1-7H3