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

Systemtic Name: 3-[(2-methoxyphenyl)-pyridin-3-ylcarbonyl-amino]propylazanium Openeye Name: 3-[2-methoxy-N-(pyridine-3-carbonyl)anilino]propylammonium CAS Name: 3-(2-methoxy-N-[oxo(3-pyridinyl)methyl]anilino)propylammonium IUPAC Name: 3-[2-methoxy-N-(pyridine-3-carbonyl)anilino]propylazanium Traditional Name: 3-(2-methoxy-N-nicotinoyl-anilino)propylammonium Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CCC[NH3+])C(=O)C2=CN=CC=C2

Isomeric SMILES

COC1=CC=CC=C1N(CCC[NH3+])C(=O)C2=CN=CC=C2

InChI

InChI=1S/C16H19N3O2/c1-21-15-8-3-2-7-14(15)19(11-5-9-17)16(20)13-6-4-10-18-12-13/h2-4,6-8,10,12H,5,9,11,17H2,1H3/p+1