4-oxidanylidene-3-[2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]phthalazine-1-carboxylate

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]phthalazine-1-carboxylate Openeye Name: 4-oxo-3-[2-oxo-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl]phthalazine-1-carboxylate CAS Name: 4-oxo-3-[2-oxo-2-[[(2S)-2-oxolanyl]methylamino]ethyl]-1-phthalazinecarboxylate IUPAC Name: 4-oxo-3-[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]phthalazine-1-carboxylate Traditional Name: 4-keto-3-[2-keto-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]ethyl]phthalazine-1-carboxylate Formula: C16H16N3O5- MolecularWeight: 330.31534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

C1C[C@H](OC1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C16H17N3O5/c20-13(17-8-10-4-3-7-24-10)9-19-15(21)12-6-2-1-5-11(12)14(18-19)16(22)23/h1-2,5-6,10H,3-4,7-9H2,(H,17,20)(H,22,23)/p-1/t10-/m0/s1