(2-oxidanylidene-2-phenylazanyl-ethyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 3-hexyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-hexyl-4-oxo-1-phthalazinecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-hexyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-hexyl-4-keto-phthalazine-1-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O4/c1-2-3-4-10-15-26-22(28)19-14-9-8-13-18(19)21(25-26)23(29)30-16-20(27)24-17-11-6-5-7-12-17/h5-9,11-14H,2-4,10,15-16H2,1H3,(H,24,27)