prop-2-enyl 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxidanylidene-hexan-2-yl)oxy-naphthalen-2-yl]benzoate

Systemtic Name: prop-2-enyl 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxidanylidene-hexan-2-yl)oxy-naphthalen-2-yl]benzoate Openeye Name: allyl 4-[7-(1-adamantyl)-6-(1-ethoxycarbonylpentoxy)-2-naphthyl]benzoate CAS Name: 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxohexan-2-yl)oxy-2-naphthalenyl]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxohexan-2-yl)oxynaphthalen-2-yl]benzoate Traditional Name: 4-[7-(1-adamantyl)-6-(1-carbethoxypentoxy)-2-naphthyl]benzoic acid allyl ester Formula: C38H44O5 MolecularWeight: 580.75296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)OC1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)OCC=C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCC(C(=O)OCC)OC1=C(C=C2C=C(C=CC2=C1)C3=CC=C(C=C3)C(=O)OCC=C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C38H44O5/c1-4-7-8-34(37(40)41-6-3)43-35-21-31-14-13-30(28-9-11-29(12-10-28)36(39)42-15-5-2)19-32(31)20-33(35)38-22-25-16-26(23-38)18-27(17-25)24-38/h5,9-14,19-21,25-27,34H,2,4,6-8,15-18,22-24H2,1,3H3