(4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate

Systemtic Name: (4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate Openeye Name: (4-allyloxycarbonylphenyl) 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate CAS Name: 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoic acid [4-[oxo(prop-2-enoxy)methyl]phenyl] ester IUPAC Name: (4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoate Traditional Name: 3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoic acid (4-allyloxycarbonylphenyl) ester Formula: C31H36O7 MolecularWeight: 520.61334

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC=C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(OC)OCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC=C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C31H36O7/c1-4-11-35-29(32)24-5-8-26(9-6-24)38-30(33)25-7-10-28(37-19-36-20(2)34-3)27(15-25)31-16-21-12-22(17-31)14-23(13-21)18-31/h4-10,15,20-23H,1,11-14,16-19H2,2-3H3