sodium 2-[3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]ethanoate

Systemtic Name: sodium 2-[3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]ethanoate Openeye Name: sodium 2-[3-[3-(2-benzyloxy-5-chloro-phenyl)-2-thienyl]phenyl]acetate CAS Name: sodium 2-[3-[3-(5-chloro-2-phenylmethoxyphenyl)-2-thiophenyl]phenyl]acetate IUPAC Name: sodium 2-[3-[3-(5-chloro-2-phenylmethoxyphenyl)thiophen-2-yl]phenyl]acetate Traditional Name: sodium 2-[3-[3-(2-benzoxy-5-chloro-phenyl)-2-thienyl]phenyl]acetate Formula: C25H18ClNaO3S MolecularWeight: 456.91639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=CC=C4)CC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=CC=C4)CC(=O)[O-].[Na+]

InChI

InChI=1S/C25H19ClO3S.Na/c26-20-9-10-23(29-16-17-5-2-1-3-6-17)22(15-20)21-11-12-30-25(21)19-8-4-7-18(13-19)14-24(27)28;/h1-13,15H,14,16H2,(H,27,28);/q;+1/p-1