6-[4-(acetyloxymethyl)-3-(1-adamantyl)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[4-(acetyloxymethyl)-3-(1-adamantyl)phenyl]naphthalene-2-carboxylic acid Openeye Name: 6-[4-(acetoxymethyl)-3-(1-adamantyl)phenyl]naphthalene-2-carboxylic acid CAS Name: 6-[4-(acetyloxymethyl)-3-(1-adamantyl)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[4-(acetyloxymethyl)-3-(1-adamantyl)phenyl]naphthalene-2-carboxylic acid Traditional Name: 6-[4-(acetoxymethyl)-3-(1-adamantyl)phenyl]-2-naphthoic acid Formula: C30H30O4 MolecularWeight: 454.5568

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(=O)OCC1=C(C=C(C=C1)C2=CC3=C(C=C2)C=C(C=C3)C(=O)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H30O4/c1-18(31)34-17-27-7-5-25(23-2-3-24-12-26(29(32)33)6-4-22(24)11-23)13-28(27)30-14-19-8-20(15-30)10-21(9-19)16-30/h2-7,11-13,19-21H,8-10,14-17H2,1H3,(H,32,33)