(phenylmethyl) 3-(1-adamantyl)-6-(4-methoxycarbonylphenyl)naphthalene-2-carboxylate

Systemtic Name: (phenylmethyl) 3-(1-adamantyl)-6-(4-methoxycarbonylphenyl)naphthalene-2-carboxylate Openeye Name: benzyl 3-(1-adamantyl)-6-(4-methoxycarbonylphenyl)naphthalene-2-carboxylate CAS Name: 3-(1-adamantyl)-6-(4-methoxycarbonylphenyl)-2-naphthalenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1-adamantyl)-6-(4-methoxycarbonylphenyl)naphthalene-2-carboxylate Traditional Name: 3-(1-adamantyl)-6-(4-carbomethoxyphenyl)naphthalene-2-carboxylic acid benzyl ester Formula: C36H34O4 MolecularWeight: 530.65276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)C(=O)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC3=CC(=C(C=C3C=C2)C(=O)OCC4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C36H34O4/c1-39-34(37)28-9-7-27(8-10-28)29-11-12-30-17-32(35(38)40-22-23-5-3-2-4-6-23)33(18-31(30)16-29)36-19-24-13-25(20-36)15-26(14-24)21-36/h2-12,16-18,24-26H,13-15,19-22H2,1H3