N-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethoxy)phenyl]-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(2-amino-2-oxoethoxy)phenyl]-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethoxy)phenyl]-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethoxy)phenyl]-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O4/c1-2-3-4-7-14-27-23(30)19-9-6-5-8-18(19)21(26-27)22(29)25-16-10-12-17(13-11-16)31-15-20(24)28/h5-6,8-13H,2-4,7,14-15H2,1H3,(H2,24,28)(H,25,29)