propan-2-yl (3S)-3-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]-3-(2-chlorophenyl)propanoate

Systemtic Name: propan-2-yl (3S)-3-[2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoylamino]-3-(2-chlorophenyl)propanoate Openeye Name: isopropyl (3S)-3-[[2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetyl]amino]-3-(2-chlorophenyl)propanoate CAS Name: (3S)-3-[[2-(4-carbamoyl-1-oxo-2-phthalazinyl)-1-oxoethyl]amino]-3-(2-chlorophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-[[2-(4-carbamoyl-1-oxophthalazin-2-yl)acetyl]amino]-3-(2-chlorophenyl)propanoate Traditional Name: (3S)-3-[[2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetyl]amino]-3-(2-chlorophenyl)propionic acid isopropyl ester Formula: C23H23ClN4O5 MolecularWeight: 470.90552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

Isomeric SMILES

CC(C)OC(=O)C[C@@H](C1=CC=CC=C1Cl)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N

InChI

InChI=1S/C23H23ClN4O5/c1-13(2)33-20(30)11-18(16-9-5-6-10-17(16)24)26-19(29)12-28-23(32)15-8-4-3-7-14(15)21(27-28)22(25)31/h3-10,13,18H,11-12H2,1-2H3,(H2,25,31)(H,26,29)/t18-/m0/s1