methyl 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)naphthalen-2-yl]-2-chloranyl-benzoate

Systemtic Name: methyl 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)naphthalen-2-yl]-2-chloranyl-benzoate Openeye Name: methyl 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)-2-naphthyl]-2-chloro-benzoate CAS Name: 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)-2-naphthalenyl]-2-chlorobenzoic acid methyl ester IUPAC Name: methyl 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)naphthalen-2-yl]-2-chlorobenzoate Traditional Name: 4-[7-(1-adamantyl)-6-(1-methoxyethoxymethoxy)-2-naphthyl]-2-chloro-benzoic acid methyl ester Formula: C32H35ClO5 MolecularWeight: 535.0703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C2C=C(C=CC2=C1)C3=CC(=C(C=C3)C(=O)OC)Cl)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(OC)OCOC1=C(C=C2C=C(C=CC2=C1)C3=CC(=C(C=C3)C(=O)OC)Cl)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C32H35ClO5/c1-19(35-2)37-18-38-30-14-25-5-4-23(24-6-7-27(29(33)13-24)31(34)36-3)11-26(25)12-28(30)32-15-20-8-21(16-32)10-22(9-20)17-32/h4-7,11-14,19-22H,8-10,15-18H2,1-3H3