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

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3,5-dimethylisoxazol-4-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3,5-dimethyl-4-isoxazolyl)-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3,5-dimethylisoxazol-4-yl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3/c1-14-17(15(2)24-19-14)18(22)21-10-8-20(9-11-21)12-13-23-16-6-4-3-5-7-16/h3-7H,8-13H2,1-2H3/p+1