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

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC

InChI

InChI=1S/C17H21N3O4/c1-3-5-10-18-14(21)11-24-17(23)15-12-8-6-7-9-13(12)16(22)20(4-2)19-15/h6-9H,3-5,10-11H2,1-2H3,(H,18,21)