2-[2-[(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethoxy]ethanoic acid

Systemtic Name: 2-[2-[(3-cyano-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethoxy]ethanoic acid Openeye Name: 2-[2-[(3-cyano-5-methyl-4-phenyl-2-thienyl)amino]-2-oxo-ethoxy]acetic acid CAS Name: 2-[2-[(3-cyano-5-methyl-4-phenyl-2-thiophenyl)amino]-2-oxoethoxy]acetic acid IUPAC Name: 2-[2-[(3-cyano-5-methyl-4-phenylthiophen-2-yl)amino]-2-oxoethoxy]acetic acid Traditional Name: 2-[2-[(3-cyano-5-methyl-4-phenyl-2-thienyl)amino]-2-keto-ethoxy]acetic acid Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)COCC(=O)O)C#N)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)COCC(=O)O)C#N)C2=CC=CC=C2

InChI

InChI=1S/C16H14N2O4S/c1-10-15(11-5-3-2-4-6-11)12(7-17)16(23-10)18-13(19)8-22-9-14(20)21/h2-6H,8-9H2,1H3,(H,18,19)(H,20,21)