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

Systemtic Name: (2E,4Z)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(3-ethoxycarbonylphenyl)hepta-2,4-dienoate Openeye Name: (2E,4Z)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(3-ethoxycarbonylphenyl)hepta-2,4-dienoate CAS Name: (2E,4Z)-7-[3-(1-adamantyl)-4-methoxyphenyl]-4-(3-ethoxycarbonylphenyl)hepta-2,4-dienoate IUPAC Name: (2E,4Z)-7-[3-(1-adamantyl)-4-methoxyphenyl]-4-(3-ethoxycarbonylphenyl)hepta-2,4-dienoate Traditional Name: (2E,4Z)-7-[3-(1-adamantyl)-4-methoxy-phenyl]-4-(3-carbethoxyphenyl)hepta-2,4-dienoate Formula: C33H37O5- MolecularWeight: 513.64388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C(=CCCC2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4)C=CC(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)/C(=C\CCC2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4)/C=C/C(=O)[O-]

InChI

InChI=1S/C33H38O5/c1-3-38-32(36)28-9-5-8-27(18-28)26(11-13-31(34)35)7-4-6-22-10-12-30(37-2)29(17-22)33-19-23-14-24(20-33)16-25(15-23)21-33/h5,7-13,17-18,23-25H,3-4,6,14-16,19-21H2,1-2H3,(H,34,35)/p-1/b13-11+,26-7-