3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[2-[(9-ethyl-3-carbazolyl)amino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-[2-[(9-ethylcarbazol-3-yl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylic acid Formula: C25H20N4O4 MolecularWeight: 440.4507

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)O)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)O)C5=CC=CC=C51

InChI

InChI=1S/C25H20N4O4/c1-2-28-20-10-6-5-7-16(20)19-13-15(11-12-21(19)28)26-22(30)14-29-24(31)18-9-4-3-8-17(18)23(27-29)25(32)33/h3-13H,2,14H2,1H3,(H,26,30)(H,32,33)