N-(3-morpholin-4-ium-4-ylpropyl)-1-(phenylcarbamoylamino)cyclohexane-1-carboxamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-1-(phenylcarbamoylamino)cyclohexane-1-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-1-(phenylcarbamoylamino)cyclohexanecarboxamide CAS Name: 1-[[anilino(oxo)methyl]amino]-N-[3-(4-morpholin-4-iumyl)propyl]-1-cyclohexanecarboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-1-(phenylcarbamoylamino)cyclohexane-1-carboxamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-1-(phenylcarbamoylamino)cyclohexanecarboxamide Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCCC[NH+]2CCOCC2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)(C(=O)NCCC[NH+]2CCOCC2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H32N4O3/c26-19(22-12-7-13-25-14-16-28-17-15-25)21(10-5-2-6-11-21)24-20(27)23-18-8-3-1-4-9-18/h1,3-4,8-9H,2,5-7,10-17H2,(H,22,26)(H2,23,24,27)/p+1