(E)-3-[4-[3-(1-adamantyl)-4-phenylmethoxy-phenyl]-3,5-dimethoxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[3-(1-adamantyl)-4-phenylmethoxy-phenyl]-3,5-dimethoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[4-[3-(1-adamantyl)-4-benzyloxy-phenyl]-3,5-dimethoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-[3-(1-adamantyl)-4-phenylmethoxyphenyl]-3,5-dimethoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[4-[3-(1-adamantyl)-4-phenylmethoxyphenyl]-3,5-dimethoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-[3-(1-adamantyl)-4-benzoxy-phenyl]-3,5-dimethoxy-phenyl]acrylate Formula: C34H35O5- MolecularWeight: 523.6387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5)OC)C=CC(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)C45CC6CC(C4)CC(C6)C5)OC)/C=C/C(=O)[O-]

InChI

InChI=1S/C34H36O5/c1-37-30-15-23(8-11-32(35)36)16-31(38-2)33(30)27-9-10-29(39-21-22-6-4-3-5-7-22)28(17-27)34-18-24-12-25(19-34)14-26(13-24)20-34/h3-11,15-17,24-26H,12-14,18-21H2,1-2H3,(H,35,36)/p-1/b11-8+