(phenylmethyl) 6-[3-(1-adamantyl)-4-prop-2-enyl-phenyl]naphthalene-2-carboxylate

Systemtic Name: (phenylmethyl) 6-[3-(1-adamantyl)-4-prop-2-enyl-phenyl]naphthalene-2-carboxylate Openeye Name: benzyl 6-[3-(1-adamantyl)-4-allyl-phenyl]naphthalene-2-carboxylate CAS Name: 6-[3-(1-adamantyl)-4-prop-2-enylphenyl]-2-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[3-(1-adamantyl)-4-prop-2-enylphenyl]naphthalene-2-carboxylate Traditional Name: 6-[3-(1-adamantyl)-4-allyl-phenyl]naphthalene-2-carboxylic acid benzyl ester Formula: C37H36O2 MolecularWeight: 512.68054

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C=CCC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C37H36O2/c1-2-6-29-9-10-33(20-35(29)37-21-26-15-27(22-37)17-28(16-26)23-37)31-11-12-32-19-34(14-13-30(32)18-31)36(38)39-24-25-7-4-3-5-8-25/h2-5,7-14,18-20,26-28H,1,6,15-17,21-24H2