3-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(indan-5-ylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(indan-5-ylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C20H16N3O4- MolecularWeight: 362.35874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

InChI

InChI=1S/C20H17N3O4/c24-17(21-14-9-8-12-4-3-5-13(12)10-14)11-23-19(25)16-7-2-1-6-15(16)18(22-23)20(26)27/h1-2,6-10H,3-5,11H2,(H,21,24)(H,26,27)/p-1