3-[(4-ethylphenyl)-pyridin-3-ylcarbonyl-amino]propylazanium

Systemtic Name: 3-[(4-ethylphenyl)-pyridin-3-ylcarbonyl-amino]propylazanium Openeye Name: 3-[4-ethyl-N-(pyridine-3-carbonyl)anilino]propylammonium CAS Name: 3-(4-ethyl-N-[oxo(3-pyridinyl)methyl]anilino)propylammonium IUPAC Name: 3-[4-ethyl-N-(pyridine-3-carbonyl)anilino]propylazanium Traditional Name: 3-(4-ethyl-N-nicotinoyl-anilino)propylammonium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CCC[NH3+])C(=O)C2=CN=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)N(CCC[NH3+])C(=O)C2=CN=CC=C2

InChI

InChI=1S/C17H21N3O/c1-2-14-6-8-16(9-7-14)20(12-4-10-18)17(21)15-5-3-11-19-13-15/h3,5-9,11,13H,2,4,10,12,18H2,1H3/p+1