4-oxidanylidene-3-[3-oxidanylidene-3-[(4-pyrrolidin-1-ylphenyl)amino]propyl]phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-3-[3-oxidanylidene-3-[(4-pyrrolidin-1-ylphenyl)amino]propyl]phthalazin-1-olate Openeye Name: 4-oxo-3-[3-oxo-3-(4-pyrrolidin-1-ylanilino)propyl]phthalazin-1-olate CAS Name: 4-oxo-3-[3-oxo-3-[4-(1-pyrrolidinyl)anilino]propyl]-1-phthalazinolate IUPAC Name: 4-oxo-3-[3-oxo-3-(4-pyrrolidin-1-ylanilino)propyl]phthalazin-1-olate Traditional Name: 4-keto-3-[3-keto-3-(4-pyrrolidinoanilino)propyl]phthalazin-1-olate Formula: C21H21N4O3- MolecularWeight: 377.41644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C21H22N4O3/c26-19(22-15-7-9-16(10-8-15)24-12-3-4-13-24)11-14-25-21(28)18-6-2-1-5-17(18)20(27)23-25/h1-2,5-10H,3-4,11-14H2,(H,22,26)(H,23,27)/p-1