(3E)-3-[(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one

Systemtic Name: (3E)-3-[(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one Openeye Name: (3E)-3-[(4,6-dimethylpyrimidin-2-yl)hydrazono]-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indolin-2-one CAS Name: (3E)-3-[(4,6-dimethyl-2-pyrimidinyl)hydrazinylidene]-1-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-indolone IUPAC Name: (3E)-3-[(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indol-2-one Traditional Name: (3E)-3-[(4,6-dimethylpyrimidin-2-yl)hydrazono]-1-[(4-methylpiperidin-1-ium-1-yl)methyl]oxindole Formula: C21H27N6O+ MolecularWeight: 379.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C3=CC=CC=C3C(=NNC4=NC(=CC(=N4)C)C)C2=O

Isomeric SMILES

CC1CC[NH+](CC1)CN2C3=CC=CC=C3/C(=N\NC4=NC(=CC(=N4)C)C)/C2=O

InChI

InChI=1S/C21H26N6O/c1-14-8-10-26(11-9-14)13-27-18-7-5-4-6-17(18)19(20(27)28)24-25-21-22-15(2)12-16(3)23-21/h4-7,12,14H,8-11,13H2,1-3H3,(H,22,23,25)/p+1/b24-19+