(2R)-3-(1H-indol-3-yl)-2-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]propanoic acid Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[(4-oxo-3H-phthalazine-1-carbonyl)amino]propanoic acid CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(4-oxo-3H-phthalazine-1-carbonyl)amino]propanoic acid Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(4-keto-3H-phthalazine-1-carbonyl)amino]propionic acid Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C20H16N4O4/c25-18-14-7-2-1-6-13(14)17(23-24-18)19(26)22-16(20(27)28)9-11-10-21-15-8-4-3-5-12(11)15/h1-8,10,16,21H,9H2,(H,22,26)(H,24,25)(H,27,28)/t16-/m1/s1