[1-(phenylmethyl)piperazin-1-ium-1-yl]carbamic acid

Systemtic Name: [1-(phenylmethyl)piperazin-1-ium-1-yl]carbamic acid Openeye Name: (1-benzylpiperazin-1-ium-1-yl)carbamic acid CAS Name: [1-(phenylmethyl)-1-piperazin-1-iumyl]carbamic acid IUPAC Name: (1-benzylpiperazin-1-ium-1-yl)carbamic acid Traditional Name: (1-benzylpiperazin-1-ium-1-yl)carbamic acid Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CC2=CC=CC=C2)NC(=O)O

Isomeric SMILES

C1C[N+](CCN1)(CC2=CC=CC=C2)NC(=O)O

InChI

InChI=1S/C12H17N3O2/c16-12(17)14-15(8-6-13-7-9-15)10-11-4-2-1-3-5-11/h1-5,13-14H,6-10H2/p+1