tert-butyl N-[(2S)-4-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-3-oxidanylidene-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-3-(1,4-dioxo-3H-phthalazin-2-yl)-2-oxo-propyl]carbamate CAS Name: N-[(2S)-4-(1,4-dioxo-3H-phthalazin-2-yl)-3-oxo-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-(1,4-dioxo-3H-phthalazin-2-yl)-3-oxo-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-3-(1,4-diketo-3H-phthalazin-2-yl)-2-keto-propyl]carbamic acid tert-butyl ester Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C23H25N3O5/c1-23(2,3)31-22(30)24-18(13-15-9-5-4-6-10-15)19(27)14-26-21(29)17-12-8-7-11-16(17)20(28)25-26/h4-12,18H,13-14H2,1-3H3,(H,24,30)(H,25,28)/t18-/m0/s1