(2E,4E)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-phenyl-hepta-2,4-dienoate

Systemtic Name: (2E,4E)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-phenyl-hepta-2,4-dienoate Openeye Name: (2E,4E)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-phenyl-hepta-2,4-dienoate CAS Name: (2E,4E)-7-[3-(1-adamantyl)-4-methoxyphenyl]-4-phenylhepta-2,4-dienoate IUPAC Name: (2E,4E)-7-[3-(1-adamantyl)-4-methoxyphenyl]-4-phenylhepta-2,4-dienoate Traditional Name: (2E,4E)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-phenyl-hepta-2,4-dienoate Formula: C30H33O3- MolecularWeight: 441.58122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC=C(C=CC(=O)[O-])C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=C(C=C1)CC/C=C(\C=C\C(=O)[O-])/C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C30H34O3/c1-33-28-12-10-21(6-5-9-26(11-13-29(31)32)25-7-3-2-4-8-25)17-27(28)30-18-22-14-23(19-30)16-24(15-22)20-30/h2-4,7-13,17,22-24H,5-6,14-16,18-20H2,1H3,(H,31,32)/p-1/b13-11+,26-9+