3-[2-[2-(3-methoxy-4-propan-2-yloxy-phenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[2-[2-(3-methoxy-4-propan-2-yloxy-phenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[2-[2-(4-isopropoxy-3-methoxy-benzoyl)hydrazino]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[2-[[(3-methoxy-4-propan-2-yloxyphenyl)-oxomethyl]hydrazo]-2-oxoethyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[2-[2-(3-methoxy-4-propan-2-yloxybenzoyl)hydrazinyl]-2-oxoethyl]-4-oxophthalazin-1-olate Traditional Name: 3-[2-[N'-(4-isopropoxy-3-methoxy-benzoyl)hydrazino]-2-keto-ethyl]-4-keto-phthalazin-1-olate Formula: C21H21N4O6- MolecularWeight: 425.41464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-])OC

InChI

InChI=1S/C21H22N4O6/c1-12(2)31-16-9-8-13(10-17(16)30-3)19(27)23-22-18(26)11-25-21(29)15-7-5-4-6-14(15)20(28)24-25/h4-10,12H,11H2,1-3H3,(H,22,26)(H,23,27)(H,24,28)/p-1