[(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] benzoate

Systemtic Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] benzoate Openeye Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] benzoate CAS Name: benzoic acid [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] ester IUPAC Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] benzoate Traditional Name: benzoic acid [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]prop-1-enyl] ester Formula: C30H36O5 MolecularWeight: 476.60384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H36O5/c1-20(18-33-29(31)25-7-5-4-6-8-25)26-9-10-27(28(14-26)35-19-34-21(2)32-3)30-15-22-11-23(16-30)13-24(12-22)17-30/h4-10,14,18,21-24H,11-13,15-17,19H2,1-3H3/b20-18+