N-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide

Systemtic Name: N-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-anilino]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[2-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylanilino]-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylanilino]-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-[2-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-anilino]-2-keto-ethyl]cyclohexanecarboxamide Formula: C22H35N4O2+ MolecularWeight: 387.5389

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CNC(=O)C3CCCCC3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CNC(=O)C3CCCCC3)C

InChI

InChI=1S/C22H34N4O2/c1-3-25-11-13-26(14-12-25)19-9-10-20(17(2)15-19)24-21(27)16-23-22(28)18-7-5-4-6-8-18/h9-10,15,18H,3-8,11-14,16H2,1-2H3,(H,23,28)(H,24,27)/p+1