(4-prop-2-enoxycarbonylphenyl) 5-(1-adamantyl)-2,4-dimethoxy-benzoate

Systemtic Name: (4-prop-2-enoxycarbonylphenyl) 5-(1-adamantyl)-2,4-dimethoxy-benzoate Openeye Name: (4-allyloxycarbonylphenyl) 5-(1-adamantyl)-2,4-dimethoxy-benzoate CAS Name: 5-(1-adamantyl)-2,4-dimethoxybenzoic acid [4-[oxo(prop-2-enoxy)methyl]phenyl] ester IUPAC Name: (4-prop-2-enoxycarbonylphenyl) 5-(1-adamantyl)-2,4-dimethoxybenzoate Traditional Name: 5-(1-adamantyl)-2,4-dimethoxy-benzoic acid (4-allyloxycarbonylphenyl) ester Formula: C29H32O6 MolecularWeight: 476.56078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC2=CC=C(C=C2)C(=O)OCC=C)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC2=CC=C(C=C2)C(=O)OCC=C)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C29H32O6/c1-4-9-34-27(30)21-5-7-22(8-6-21)35-28(31)23-13-24(26(33-3)14-25(23)32-2)29-15-18-10-19(16-29)12-20(11-18)17-29/h4-8,13-14,18-20H,1,9-12,15-17H2,2-3H3