(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC(C)C(=O)N3CCCC3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC(C)C(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O4/c1-3-4-13-23-19(25)16-10-6-5-9-15(16)17(21-23)20(26)27-14(2)18(24)22-11-7-8-12-22/h5-6,9-10,14H,3-4,7-8,11-13H2,1-2H3