3-[(2-methylphenyl)-pyridin-3-ylcarbonyl-amino]propylazanium

Systemtic Name: 3-[(2-methylphenyl)-pyridin-3-ylcarbonyl-amino]propylazanium Openeye Name: 3-[2-methyl-N-(pyridine-3-carbonyl)anilino]propylammonium CAS Name: 3-(2-methyl-N-[oxo(3-pyridinyl)methyl]anilino)propylammonium IUPAC Name: 3-[2-methyl-N-(pyridine-3-carbonyl)anilino]propylazanium Traditional Name: 3-(2-methyl-N-nicotinoyl-anilino)propylammonium Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CCC[NH3+])C(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=CC=CC=C1N(CCC[NH3+])C(=O)C2=CN=CC=C2

InChI

InChI=1S/C16H19N3O/c1-13-6-2-3-8-15(13)19(11-5-9-17)16(20)14-7-4-10-18-12-14/h2-4,6-8,10,12H,5,9,11,17H2,1H3/p+1