4-oxidanylidene-3-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]phthalazine-1-carboxylate

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl]phthalazine-1-carboxylate Openeye Name: 3-[2-(allylcarbamoylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-[2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl]-1-phthalazinecarboxylate IUPAC Name: 4-oxo-3-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]phthalazine-1-carboxylate Traditional Name: 3-[2-(allylcarbamoylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C15H13N4O5- MolecularWeight: 329.28752

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)[O-]

Isomeric SMILES

C=CCNC(=O)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)[O-]

InChI

InChI=1S/C15H14N4O5/c1-2-7-16-15(24)17-11(20)8-19-13(21)10-6-4-3-5-9(10)12(18-19)14(22)23/h2-6H,1,7-8H2,(H,22,23)(H2,16,17,20,24)/p-1