(5-methyl-1,2-oxazol-3-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (5-methylisoxazol-3-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-methyl-3-isoxazolyl)-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (5-methyl-1,2-oxazol-3-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (5-methylisoxazol-3-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)C(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O3/c1-14-13-16(18-23-14)17(21)20-9-7-19(8-10-20)11-12-22-15-5-3-2-4-6-15/h2-6,13H,7-12H2,1H3/p+1