2-methoxycarbonyl-3-(2-methylpropyl)-5-phenylmethoxy-benzoic acid

Systemtic Name: 2-methoxycarbonyl-3-(2-methylpropyl)-5-phenylmethoxy-benzoic acid Openeye Name: 5-benzyloxy-3-isobutyl-2-methoxycarbonyl-benzoic acid CAS Name: 2-methoxycarbonyl-3-(2-methylpropyl)-5-phenylmethoxybenzoic acid IUPAC Name: 2-methoxycarbonyl-3-(2-methylpropyl)-5-phenylmethoxybenzoic acid Traditional Name: 5-benzoxy-2-carbomethoxy-3-isobutyl-benzoic acid Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)O)C(=O)OC

Isomeric SMILES

CC(C)CC1=C(C(=CC(=C1)OCC2=CC=CC=C2)C(=O)O)C(=O)OC

InChI

InChI=1S/C20H22O5/c1-13(2)9-15-10-16(25-12-14-7-5-4-6-8-14)11-17(19(21)22)18(15)20(23)24-3/h4-8,10-11,13H,9,12H2,1-3H3,(H,21,22)