N'-[3-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]propanoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[3-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]propanoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-[3-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]propanoyl]-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[3-[(2R,6R)-2,6-dimethyl-1-piperidin-1-iumyl]-1-oxopropyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[3-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]propanoyl]-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-[3-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]propanoyl]-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C22H32N5O3+ MolecularWeight: 414.52118

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CC[NH+]3C(CCCC3C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CC[NH+]3[C@@H](CCC[C@H]3C)C

InChI

InChI=1S/C22H31N5O3/c1-4-13-27-22(30)18-11-6-5-10-17(18)20(25-27)21(29)24-23-19(28)12-14-26-15(2)8-7-9-16(26)3/h5-6,10-11,15-16H,4,7-9,12-14H2,1-3H3,(H,23,28)(H,24,29)/p+1/t15-,16-/m1/s1