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

Systemtic Name: prop-2-enyl 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxidanylidene-pentan-2-yl)oxy-naphthalen-2-yl]benzoate Openeye Name: allyl 4-[7-(1-adamantyl)-6-(1-ethoxycarbonylbutoxy)-2-naphthyl]benzoate CAS Name: 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxopentan-2-yl)oxy-2-naphthalenyl]benzoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[7-(1-adamantyl)-6-(1-ethoxy-1-oxopentan-2-yl)oxynaphthalen-2-yl]benzoate Traditional Name: 4-[7-(1-adamantyl)-6-(1-carbethoxybutoxy)-2-naphthyl]benzoic acid allyl ester Formula: C37H42O5 MolecularWeight: 566.72638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(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

CCCC(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/C37H42O5/c1-4-7-33(36(39)40-6-3)42-34-20-30-13-12-29(27-8-10-28(11-9-27)35(38)41-14-5-2)18-31(30)19-32(34)37-21-24-15-25(22-37)17-26(16-24)23-37/h5,8-13,18-20,24-26,33H,2,4,6-7,14-17,21-23H2,1,3H3