2-[(2-chloranyl-6-thiophen-2-yl-phenyl)methyl]-3-ethoxy-3-oxidanylidene-propanoate

Systemtic Name: 2-[(2-chloranyl-6-thiophen-2-yl-phenyl)methyl]-3-ethoxy-3-oxidanylidene-propanoate Openeye Name: 2-[[2-chloro-6-(2-thienyl)phenyl]methyl]-3-ethoxy-3-oxo-propanoate CAS Name: 2-[(2-chloro-6-thiophen-2-ylphenyl)methyl]-3-ethoxy-3-oxopropanoate IUPAC Name: 2-[(2-chloro-6-thiophen-2-ylphenyl)methyl]-3-ethoxy-3-oxopropanoate Traditional Name: 2-[2-chloro-6-(2-thienyl)benzyl]-3-ethoxy-3-keto-propionate Formula: C16H14ClO4S- MolecularWeight: 337.79796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=CC=C1Cl)C2=CC=CS2)C(=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=C(C=CC=C1Cl)C2=CC=CS2)C(=O)[O-]

InChI

InChI=1S/C16H15ClO4S/c1-2-21-16(20)12(15(18)19)9-11-10(5-3-6-13(11)17)14-7-4-8-22-14/h3-8,12H,2,9H2,1H3,(H,18,19)/p-1