tert-butyl 4-(2-methoxyphenyl)-4-oxidanidyl-piperazin-4-ium-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methoxyphenyl)-4-oxidanidyl-piperazin-4-ium-1-carboxylate Openeye Name: tert-butyl 4-(2-methoxyphenyl)-4-oxido-piperazin-4-ium-1-carboxylate CAS Name: 4-(2-methoxyphenyl)-4-oxido-1-piperazin-4-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methoxyphenyl)-4-oxidopiperazin-4-ium-1-carboxylate Traditional Name: 4-(2-methoxyphenyl)-4-oxido-piperazin-4-ium-1-carboxylic acid tert-butyl ester Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC[N+](CC1)(C2=CC=CC=C2OC)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[N+](CC1)(C2=CC=CC=C2OC)[O-]

InChI

InChI=1S/C16H24N2O4/c1-16(2,3)22-15(19)17-9-11-18(20,12-10-17)13-7-5-6-8-14(13)21-4/h5-8H,9-12H2,1-4H3