1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)cyclohexane-1-carboxamide Openeye Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)cyclohexanecarboxamide CAS Name: 1-[[(2,6-dimethylanilino)-oxomethyl]amino]-N-[3-(4-morpholin-4-iumyl)propyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)cyclohexane-1-carboxamide Traditional Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-morpholin-4-ium-4-ylpropyl)cyclohexanecarboxamide Formula: C23H37N4O3+ MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O3/c1-18-8-6-9-19(2)20(18)25-22(29)26-23(10-4-3-5-11-23)21(28)24-12-7-13-27-14-16-30-17-15-27/h6,8-9H,3-5,7,10-17H2,1-2H3,(H,24,28)(H2,25,26,29)/p+1