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

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]phthalazine-1-carboxylate Openeye Name: 3-[2-(benzylamino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-phthalazinecarboxylate IUPAC Name: 3-[2-(benzylamino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(benzylamino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C18H14N3O4- MolecularWeight: 336.32146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C18H15N3O4/c22-15(19-10-12-6-2-1-3-7-12)11-21-17(23)14-9-5-4-8-13(14)16(20-21)18(24)25/h1-9H,10-11H2,(H,19,22)(H,24,25)/p-1