3-(1-adamantyl)-1-[4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 3-(1-adamantyl)-1-[4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]naphthalene-2-carboxylic acid Openeye Name: 3-(1-adamantyl)-1-[4-(2-methoxy-2-oxo-ethoxy)phenyl]naphthalene-2-carboxylic acid CAS Name: 3-(1-adamantyl)-1-[4-(2-methoxy-2-oxoethoxy)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 3-(1-adamantyl)-1-[4-(2-methoxy-2-oxoethoxy)phenyl]naphthalene-2-carboxylic acid Traditional Name: 3-(1-adamantyl)-1-[4-(2-keto-2-methoxy-ethoxy)phenyl]-2-naphthoic acid Formula: C30H30O5 MolecularWeight: 470.5562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C2=C(C(=CC3=CC=CC=C32)C45CC6CC(C4)CC(C6)C5)C(=O)O

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C2=C(C(=CC3=CC=CC=C32)C45CC6CC(C4)CC(C6)C5)C(=O)O

InChI

InChI=1S/C30H30O5/c1-34-26(31)17-35-23-8-6-21(7-9-23)27-24-5-3-2-4-22(24)13-25(28(27)29(32)33)30-14-18-10-19(15-30)12-20(11-18)16-30/h2-9,13,18-20H,10-12,14-17H2,1H3,(H,32,33)