N-[2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-methyl-1H-indazole-3-carboxamide

Systemtic Name: N-[2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-N-methyl-1H-indazole-3-carboxamide Openeye Name: N-[2-[4-[2-(tert-butylamino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-N-methyl-1H-indazole-3-carboxamide CAS Name: N-[2-[4-[2-(tert-butylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-N-methyl-1H-indazole-3-carboxamide IUPAC Name: N-[2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-4-ium-1-yl]-2-oxoethyl]-N-methyl-1H-indazole-3-carboxamide Traditional Name: N-[2-[4-[2-(tert-butylamino)-2-keto-ethyl]piperazin-4-ium-1-yl]-2-keto-ethyl]-N-methyl-1H-indazole-3-carboxamide Formula: C21H31N6O3+ MolecularWeight: 415.50924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NNC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=NNC3=CC=CC=C32

InChI

InChI=1S/C21H30N6O3/c1-21(2,3)22-17(28)13-26-9-11-27(12-10-26)18(29)14-25(4)20(30)19-15-7-5-6-8-16(15)23-24-19/h5-8H,9-14H2,1-4H3,(H,22,28)(H,23,24)/p+1