methyl 3-(1-adamantyl)-5-methoxy-4-oxidanyl-benzoate

Systemtic Name: methyl 3-(1-adamantyl)-5-methoxy-4-oxidanyl-benzoate Openeye Name: methyl 3-(1-adamantyl)-4-hydroxy-5-methoxy-benzoate CAS Name: 3-(1-adamantyl)-4-hydroxy-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-(1-adamantyl)-4-hydroxy-5-methoxybenzoate Traditional Name: 3-(1-adamantyl)-4-hydroxy-5-methoxy-benzoic acid methyl ester Formula: C19H24O4 MolecularWeight: 316.39146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)C23CC4CC(C2)CC(C4)C3)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1O)C23CC4CC(C2)CC(C4)C3)C(=O)OC

InChI

InChI=1S/C19H24O4/c1-22-16-7-14(18(21)23-2)6-15(17(16)20)19-8-11-3-12(9-19)5-13(4-11)10-19/h6-7,11-13,20H,3-5,8-10H2,1-2H3