1-[(2,6-dimethylphenyl)carbamoylamino]-N-(2-morpholin-4-ium-4-ylethyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(2-morpholin-4-ium-4-ylethyl)cyclohexane-1-carboxamide Openeye Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(2-morpholin-4-ium-4-ylethyl)cyclohexanecarboxamide CAS Name: 1-[[(2,6-dimethylanilino)-oxomethyl]amino]-N-[2-(4-morpholin-4-iumyl)ethyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(2-morpholin-4-ium-4-ylethyl)cyclohexane-1-carboxamide Traditional Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(2-morpholin-4-ium-4-ylethyl)cyclohexanecarboxamide Formula: C22H35N4O3+ MolecularWeight: 403.5383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2(CCCCC2)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2(CCCCC2)C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C22H34N4O3/c1-17-7-6-8-18(2)19(17)24-21(28)25-22(9-4-3-5-10-22)20(27)23-11-12-26-13-15-29-16-14-26/h6-8H,3-5,9-16H2,1-2H3,(H,23,27)(H2,24,25,28)/p+1