3-[phenylcarbamoyl(pyridin-3-ylmethyl)amino]propylazanium

Systemtic Name: 3-[phenylcarbamoyl(pyridin-3-ylmethyl)amino]propylazanium Openeye Name: 3-[phenylcarbamoyl(3-pyridylmethyl)amino]propylammonium CAS Name: 3-[[anilino(oxo)methyl]-(3-pyridinylmethyl)amino]propylammonium IUPAC Name: 3-[phenylcarbamoyl(pyridin-3-ylmethyl)amino]propylazanium Traditional Name: 3-[phenylcarbamoyl(3-pyridylmethyl)amino]propylammonium Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)N(CCC[NH3+])CC2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)N(CCC[NH3+])CC2=CN=CC=C2

InChI

InChI=1S/C16H20N4O/c17-9-5-11-20(13-14-6-4-10-18-12-14)16(21)19-15-7-2-1-3-8-15/h1-4,6-8,10,12H,5,9,11,13,17H2,(H,19,21)/p+1