(2-azanyl-2-oxidanylidene-ethyl) 3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-(3-methylbutyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 3-isopentyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(3-methylbutyl)-4-oxo-1-phthalazinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-(3-methylbutyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-isoamyl-4-keto-phthalazine-1-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC(=O)N

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC(=O)N

InChI

InChI=1S/C16H19N3O4/c1-10(2)7-8-19-15(21)12-6-4-3-5-11(12)14(18-19)16(22)23-9-13(17)20/h3-6,10H,7-9H2,1-2H3,(H2,17,20)