2-[5-[(4-chlorophenyl)methyl]-3-methoxy-4-(methoxymethoxy)naphthalen-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[5-[(4-chlorophenyl)methyl]-3-methoxy-4-(methoxymethoxy)naphthalen-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[5-[(4-chlorophenyl)methyl]-3-methoxy-4-(methoxymethoxy)-1-naphthyl]-2-oxo-acetic acid CAS Name: 2-[5-[(4-chlorophenyl)methyl]-3-methoxy-4-(methoxymethoxy)-1-naphthalenyl]-2-oxoacetic acid IUPAC Name: 2-[5-[(4-chlorophenyl)methyl]-3-methoxy-4-(methoxymethoxy)naphthalen-1-yl]-2-oxoacetic acid Traditional Name: 2-[5-(4-chlorobenzyl)-3-methoxy-4-(methoxymethoxy)-1-naphthyl]-2-keto-acetic acid Formula: C22H19ClO6 MolecularWeight: 414.83566

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C=C(C2=C1C(=CC=C2)CC3=CC=C(C=C3)Cl)C(=O)C(=O)O)OC

Isomeric SMILES

COCOC1=C(C=C(C2=C1C(=CC=C2)CC3=CC=C(C=C3)Cl)C(=O)C(=O)O)OC

InChI

InChI=1S/C22H19ClO6/c1-27-12-29-21-18(28-2)11-17(20(24)22(25)26)16-5-3-4-14(19(16)21)10-13-6-8-15(23)9-7-13/h3-9,11H,10,12H2,1-2H3,(H,25,26)