methyl 4-azanyl-1-(piperidin-4-ylmethyl)piperidin-1-ium-1-carboxylate

Systemtic Name: methyl 4-azanyl-1-(piperidin-4-ylmethyl)piperidin-1-ium-1-carboxylate Openeye Name: methyl 4-amino-1-(4-piperidylmethyl)piperidin-1-ium-1-carboxylate CAS Name: 4-amino-1-(4-piperidinylmethyl)-1-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 4-amino-1-(piperidin-4-ylmethyl)piperidin-1-ium-1-carboxylate Traditional Name: 4-amino-1-(4-piperidylmethyl)piperidin-1-ium-1-carboxylic acid methyl ester Formula: C13H26N3O2+ MolecularWeight: 256.36444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[N+]1(CCC(CC1)N)CC2CCNCC2

Isomeric SMILES

COC(=O)[N+]1(CCC(CC1)N)CC2CCNCC2

InChI

InChI=1S/C13H26N3O2/c1-18-13(17)16(8-4-12(14)5-9-16)10-11-2-6-15-7-3-11/h11-12,15H,2-10,14H2,1H3/q+1