methyl 1-azanyl-4-azido-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl 1-azanyl-4-azido-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl 1-amino-4-azido-1-(3-pyridylmethyl)pyrrolidin-1-ium-2-carboxylate CAS Name: 1-amino-4-azido-1-(3-pyridinylmethyl)-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-amino-4-azido-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxylate Traditional Name: 1-amino-4-azido-1-(3-pyridylmethyl)pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C12H17N6O2+ MolecularWeight: 277.30238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C[N+]1(CC2=CN=CC=C2)N)N=[N+]=[N-]

Isomeric SMILES

COC(=O)C1CC(C[N+]1(CC2=CN=CC=C2)N)N=[N+]=[N-]

InChI

InChI=1S/C12H17N6O2/c1-20-12(19)11-5-10(16-17-13)8-18(11,14)7-9-3-2-4-15-6-9/h2-4,6,10-11H,5,7-8,14H2,1H3/q+1