methyl 5-(1-adamantyl)-2,4-dimethoxy-benzoate

Systemtic Name: methyl 5-(1-adamantyl)-2,4-dimethoxy-benzoate Openeye Name: methyl 5-(1-adamantyl)-2,4-dimethoxy-benzoate CAS Name: 5-(1-adamantyl)-2,4-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 5-(1-adamantyl)-2,4-dimethoxybenzoate Traditional Name: 5-(1-adamantyl)-2,4-dimethoxy-benzoic acid methyl ester Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC)C23CC4CC(C2)CC(C4)C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC)C23CC4CC(C2)CC(C4)C3)OC

InChI

InChI=1S/C20H26O4/c1-22-17-8-18(23-2)16(7-15(17)19(21)24-3)20-9-12-4-13(10-20)6-14(5-12)11-20/h7-8,12-14H,4-6,9-11H2,1-3H3