N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H20N4O2/c1-2-20-9-5-6-11(20)10-17-16(22)14-12-7-3-4-8-13(12)15(21)19-18-14/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,17,22)(H,19,21)/p+1/t11-/m1/s1