sodium 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]-4-methyl-furan-2-carboxylate

Systemtic Name: sodium 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]-4-methyl-furan-2-carboxylate Openeye Name: sodium 5-[(2-benzyloxy-5-chloro-phenyl)methyl]-4-methyl-furan-2-carboxylate CAS Name: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-4-methyl-2-furancarboxylate IUPAC Name: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-4-methylfuran-2-carboxylate Traditional Name: sodium 5-(2-benzoxy-5-chloro-benzyl)-4-methyl-2-furoate Formula: C20H16ClNaO4 MolecularWeight: 378.78141

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)C(=O)[O-])CC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3.[Na+]

Isomeric SMILES

CC1=C(OC(=C1)C(=O)[O-])CC2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3.[Na+]

InChI

InChI=1S/C20H17ClO4.Na/c1-13-9-19(20(22)23)25-18(13)11-15-10-16(21)7-8-17(15)24-12-14-5-3-2-4-6-14;/h2-10H,11-12H2,1H3,(H,22,23);/q;+1/p-1