(2E)-4-azanyl-3-oxidanylidene-2-(thiophen-3-ylmethylidene)butanoic acid

Systemtic Name: (2E)-4-azanyl-3-oxidanylidene-2-(thiophen-3-ylmethylidene)butanoic acid Openeye Name: (2E)-4-amino-3-oxo-2-(3-thienylmethylene)butanoic acid CAS Name: (2E)-4-amino-3-oxo-2-(3-thiophenylmethylidene)butanoic acid IUPAC Name: (2E)-4-amino-3-oxo-2-(thiophen-3-ylmethylidene)butanoic acid Traditional Name: (E)-2-glycyl-3-(3-thienyl)acrylic acid Formula: C9H9NO3S MolecularWeight: 211.23766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C=C(C(=O)CN)C(=O)O

Isomeric SMILES

C1=CSC=C1/C=C(\C(=O)CN)/C(=O)O

InChI

InChI=1S/C9H9NO3S/c10-4-8(11)7(9(12)13)3-6-1-2-14-5-6/h1-3,5H,4,10H2,(H,12,13)/b7-3+