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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C[N+](CCN1C(=O)O)(C2=CC=CC=C2OC)[O-]

Isomeric SMILES

CC(C)(C)C1C[N+](CCN1C(=O)O)(C2=CC=CC=C2OC)[O-]

InChI

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