sodium 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]thiophene-3-carboxylate

Systemtic Name: sodium 5-[(5-chloranyl-2-phenylmethoxy-phenyl)methyl]thiophene-3-carboxylate Openeye Name: sodium 5-[(2-benzyloxy-5-chloro-phenyl)methyl]thiophene-3-carboxylate CAS Name: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]-3-thiophenecarboxylate IUPAC Name: sodium 5-[(5-chloro-2-phenylmethoxyphenyl)methyl]thiophene-3-carboxylate Traditional Name: sodium 5-(2-benzoxy-5-chloro-benzyl)-3-thenoate Formula: C19H14ClNaO3S MolecularWeight: 380.82043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC(=CS3)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)CC3=CC(=CS3)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H15ClO3S.Na/c20-16-6-7-18(23-11-13-4-2-1-3-5-13)14(8-16)9-17-10-15(12-24-17)19(21)22;/h1-8,10,12H,9,11H2,(H,21,22);/q;+1/p-1