[3-(2-piperidin-1-ium-1-ylethanoylamino)phenyl]methylazanium

Systemtic Name: [3-(2-piperidin-1-ium-1-ylethanoylamino)phenyl]methylazanium Openeye Name: [3-[(2-piperidin-1-ium-1-ylacetyl)amino]phenyl]methylammonium CAS Name: [3-[[1-oxo-2-(1-piperidin-1-iumyl)ethyl]amino]phenyl]methylammonium IUPAC Name: [3-[(2-piperidin-1-ium-1-ylacetyl)amino]phenyl]methylazanium Traditional Name: [3-[(2-piperidin-1-ium-1-ylacetyl)amino]benzyl]ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C14H21N3O/c15-10-12-5-4-6-13(9-12)16-14(18)11-17-7-2-1-3-8-17/h4-6,9H,1-3,7-8,10-11,15H2,(H,16,18)/p+2