N-tert-butyl-2-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-(5-methyl-3-phenyl-isoxazole-4-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-(5-methyl-3-phenyl-isoxazole-4-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C21H28N4O3/c1-15-18(19(23-28-15)16-8-6-5-7-9-16)20(27)25-12-10-24(11-13-25)14-17(26)22-21(2,3)4/h5-9H,10-14H2,1-4H3,(H,22,26)/p+1