ethyl 4-methanidylpiperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-methanidylpiperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-methanidylpiperazin-4-ium-1-carboxylate CAS Name: 4-methanidyl-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-methanidylpiperazin-4-ium-1-carboxylate Traditional Name: 4-methanidylpiperazin-4-ium-1-carboxylic acid ethyl ester Formula: C8H16N2O2 MolecularWeight: 172.22484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)[CH2-]

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)[CH2-]

InChI

InChI=1S/C8H16N2O2/c1-3-12-8(11)10-6-4-9(2)5-7-10/h9H,2-7H2,1H3