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

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-(2-hydroxyethyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(2-hydroxyethyl)-4-oxo-1-phthalazinecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(2-hydroxyethyl)-4-keto-phthalazine-1-carboxylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H18N4O6 MolecularWeight: 374.34802

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCO

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCO

InChI

InChI=1S/C17H18N4O6/c1-2-7-18-17(26)19-13(23)10-27-16(25)14-11-5-3-4-6-12(11)15(24)21(20-14)8-9-22/h2-6,22H,1,7-10H2,(H2,18,19,23,26)