N-[3-chloranyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[3-chloranyl-4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3-chloro-4-[2-(diethylamino)-2-oxo-ethoxy]phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[3-chloro-4-[2-(diethylamino)-2-keto-ethoxy]phenyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)Cl

Isomeric SMILES

CCN(CC)C(=O)COC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)Cl

InChI

InChI=1S/C21H21ClN4O4/c1-3-26(4-2)18(27)12-30-17-10-9-13(11-16(17)22)23-21(29)19-14-7-5-6-8-15(14)20(28)25-24-19/h5-11H,3-4,12H2,1-2H3,(H,23,29)(H,25,28)