(2-azanyl-2-oxidanylidene-ethyl)-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (2-amino-2-oxo-ethyl)-(1-benzylpiperidin-1-ium-4-yl)ammonium CAS Name: (2-amino-2-oxoethyl)-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (2-amino-2-oxoethyl)-(1-benzylpiperidin-1-ium-4-yl)azanium Traditional Name: (2-amino-2-keto-ethyl)-(1-benzylpiperidin-1-ium-4-yl)ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C14H21N3O/c15-14(18)10-16-13-6-8-17(9-7-13)11-12-4-2-1-3-5-12/h1-5,13,16H,6-11H2,(H2,15,18)/p+2