N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[2-(2-phenoxyethanoylamino)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[2-(2-phenoxyethanoylamino)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-[2-[(2-phenoxyacetyl)amino]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[4-[1-oxo-2-[(1-oxo-2-phenoxyethyl)amino]ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[2-[(2-phenoxyacetyl)amino]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[4-[2-[(2-phenoxyacetyl)amino]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C20H26N5O5+ MolecularWeight: 416.45094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H25N5O5/c1-15-11-17(23-30-15)22-18(26)13-24-7-9-25(10-8-24)20(28)12-21-19(27)14-29-16-5-3-2-4-6-16/h2-6,11H,7-10,12-14H2,1H3,(H,21,27)(H,22,23,26)/p+1