methyl 4-oxidanylidene-3-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]phthalazine-1-carboxylate

Systemtic Name: methyl 4-oxidanylidene-3-[2-oxidanylidene-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]phthalazine-1-carboxylate Openeye Name: methyl 3-[2-[[(1R)-1-methyl-3-phenyl-propyl]amino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]-1-phthalazinecarboxylic acid methyl ester IUPAC Name: methyl 4-oxo-3-[2-oxo-2-[[(2R)-4-phenylbutan-2-yl]amino]ethyl]phthalazine-1-carboxylate Traditional Name: 4-keto-3-[2-keto-2-[[(1R)-1-methyl-3-phenyl-propyl]amino]ethyl]phthalazine-1-carboxylic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-15(12-13-16-8-4-3-5-9-16)23-19(26)14-25-21(27)18-11-7-6-10-17(18)20(24-25)22(28)29-2/h3-11,15H,12-14H2,1-2H3,(H,23,26)/t15-/m1/s1