(E)-4-oxidanylidene-4-(thiophen-2-ylmethylamino)but-2-enoate

Systemtic Name: (E)-4-oxidanylidene-4-(thiophen-2-ylmethylamino)but-2-enoate Openeye Name: (E)-4-oxo-4-(2-thienylmethylamino)but-2-enoate CAS Name: (E)-4-oxo-4-(thiophen-2-ylmethylamino)-2-butenoate IUPAC Name: (E)-4-oxo-4-(thiophen-2-ylmethylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(2-thenylamino)but-2-enoate Formula: C9H8NO3S- MolecularWeight: 210.22972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CNC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C9H9NO3S/c11-8(3-4-9(12)13)10-6-7-2-1-5-14-7/h1-5H,6H2,(H,10,11)(H,12,13)/p-1/b4-3+