(4-nitrophenyl) 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (4-nitrophenyl) 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (4-nitrophenyl) 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid (4-nitrophenyl) ester Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C15H11N3O5S/c19-13(23-11-3-1-10(2-4-11)18(21)22)5-7-17-9-16-14-12(15(17)20)6-8-24-14/h1-4,6,8-9H,5,7H2