N-(5-methyl-1,2-oxazol-3-yl)-4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(isopropylamino)-2-oxo-ethyl]-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-4-[2-oxo-2-(propan-2-ylamino)ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[2-oxo-2-(propan-2-ylamino)ethyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(isopropylamino)-2-keto-ethyl]-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide Formula: C14H24N5O3+ MolecularWeight: 310.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)N2CC[NH+](CC2)CC(=O)NC(C)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)N2CC[NH+](CC2)CC(=O)NC(C)C

InChI

InChI=1S/C14H23N5O3/c1-10(2)15-13(20)9-18-4-6-19(7-5-18)14(21)16-12-8-11(3)22-17-12/h8,10H,4-7,9H2,1-3H3,(H,15,20)(H,16,17,21)/p+1