3-[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-carbamoylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(4-carbamoylanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-carbamoylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(4-carbamoylanilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C18H13N4O5- MolecularWeight: 365.31962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=C(C=C3)C(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CC=C(C=C3)C(=O)N)C(=O)[O-]

InChI

InChI=1S/C18H14N4O5/c19-16(24)10-5-7-11(8-6-10)20-14(23)9-22-17(25)13-4-2-1-3-12(13)15(21-22)18(26)27/h1-8H,9H2,(H2,19,24)(H,20,23)(H,26,27)/p-1