(E)-4-oxidanylidene-4-(thiophen-3-ylmethylamino)oxy-but-2-enoate; propan-2-ol

Systemtic Name: (E)-4-oxidanylidene-4-(thiophen-3-ylmethylamino)oxy-but-2-enoate; propan-2-ol Openeye Name: (E)-4-oxo-4-(3-thienylmethylamino)oxy-but-2-enoate; propan-2-ol CAS Name: (E)-4-oxo-4-(3-thiophenylmethylamino)oxy-2-butenoate; 2-propanol IUPAC Name: (E)-4-oxo-4-(thiophen-3-ylmethylamino)oxybut-2-enoate; propan-2-ol Traditional Name: (E)-4-keto-4-(3-thenylamino)oxy-but-2-enoate; propan-2-ol Formula: C12H16NO5S- MolecularWeight: 286.32414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.C1=CSC=C1CNOC(=O)C=CC(=O)[O-]

Isomeric SMILES

CC(C)O.C1=CSC=C1CNOC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C9H9NO4S.C3H8O/c11-8(12)1-2-9(13)14-10-5-7-3-4-15-6-7;1-3(2)4/h1-4,6,10H,5H2,(H,11,12);3-4H,1-2H3/p-1/b2-1+;