2-[(3,5-dimethylphenyl)-pyridin-3-ylcarbonyl-amino]ethylazanium

Systemtic Name: 2-[(3,5-dimethylphenyl)-pyridin-3-ylcarbonyl-amino]ethylazanium Openeye Name: 2-[3,5-dimethyl-N-(pyridine-3-carbonyl)anilino]ethylammonium CAS Name: 2-(3,5-dimethyl-N-[oxo(3-pyridinyl)methyl]anilino)ethylammonium IUPAC Name: 2-[3,5-dimethyl-N-(pyridine-3-carbonyl)anilino]ethylazanium Traditional Name: 2-(3,5-dimethyl-N-nicotinoyl-anilino)ethylammonium Formula: C16H20N3O+ MolecularWeight: 270.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC[NH3+])C(=O)C2=CN=CC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC[NH3+])C(=O)C2=CN=CC=C2)C

InChI

InChI=1S/C16H19N3O/c1-12-8-13(2)10-15(9-12)19(7-5-17)16(20)14-4-3-6-18-11-14/h3-4,6,8-11H,5,7,17H2,1-2H3/p+1