(2R)-1-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylpiperidine-2-carboxylic acid

Systemtic Name: (2R)-1-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylpiperidine-2-carboxylic acid Openeye Name: (2R)-1-(3-isopropyl-4-oxo-phthalazine-1-carbonyl)piperidine-2-carboxylic acid CAS Name: (2R)-1-[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: (2R)-1-(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)piperidine-2-carboxylic acid Traditional Name: (2R)-1-(3-isopropyl-4-keto-phthalazine-1-carbonyl)pipecolinic acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCCC3C(=O)O

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCC[C@@H]3C(=O)O

InChI

InChI=1S/C18H21N3O4/c1-11(2)21-16(22)13-8-4-3-7-12(13)15(19-21)17(23)20-10-6-5-9-14(20)18(24)25/h3-4,7-8,11,14H,5-6,9-10H2,1-2H3,(H,24,25)/t14-/m1/s1