(1-azanyl-2-cyano-ethylidene)-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbonylamino]azanium

Systemtic Name: (1-azanyl-2-cyano-ethylidene)-[[1-(phenylmethyl)piperidin-1-ium-4-yl]carbonylamino]azanium Openeye Name: (1-amino-2-cyano-ethylidene)-[(1-benzylpiperidin-1-ium-4-carbonyl)amino]ammonium CAS Name: (1-amino-2-cyanoethylidene)-[[oxo-[1-(phenylmethyl)-4-piperidin-1-iumyl]methyl]amino]ammonium IUPAC Name: (1-amino-2-cyanoethylidene)-[(1-benzylpiperidin-1-ium-4-carbonyl)amino]azanium Traditional Name: (1-amino-2-cyano-ethylidene)-[(1-benzylpiperidin-1-ium-4-carbonyl)amino]ammonium Formula: C16H23N5O+2 MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N[NH+]=C(CC#N)N)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1C(=O)N[NH+]=C(CC#N)N)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N5O/c17-9-6-15(18)19-20-16(22)14-7-10-21(11-8-14)12-13-4-2-1-3-5-13/h1-5,14H,6-8,10-12H2,(H2,18,19)(H,20,22)/p+2