[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(2-hydroxyethyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(2-hydroxyethyl)-4-oxo-1-phthalazinecarboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(2-hydroxyethyl)-4-keto-phthalazine-1-carboxylic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCO)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=NN(C(=O)C2=CC=CC=C21)CCO)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5/c1-15(16-7-3-2-4-8-16)13-23-19(27)14-30-22(29)20-17-9-5-6-10-18(17)21(28)25(24-20)11-12-26/h2-10,15,26H,11-14H2,1H3,(H,23,27)/t15-/m1/s1