3-[(2R)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[(2R)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[(1R)-2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-[(1R)-2-keto-1-methyl-2-(o-anisidino)ethyl]phthalazine-1-carboxylate Formula: C19H16N3O5- MolecularWeight: 366.34744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1OC)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-11(17(23)20-14-9-5-6-10-15(14)27-2)22-18(24)13-8-4-3-7-12(13)16(21-22)19(25)26/h3-11H,1-2H3,(H,20,23)(H,25,26)/p-1/t11-/m1/s1