(3-carboxyphenyl)-diethanoyl-(1-pyridin-2-ylethyl)azanium

Systemtic Name: (3-carboxyphenyl)-diethanoyl-(1-pyridin-2-ylethyl)azanium Openeye Name: diacetyl-(3-carboxyphenyl)-[1-(2-pyridyl)ethyl]ammonium CAS Name: diacetyl-(3-carboxyphenyl)-[1-(2-pyridinyl)ethyl]ammonium IUPAC Name: diacetyl-(3-carboxyphenyl)-(1-pyridin-2-ylethyl)azanium Traditional Name: diacetyl-(3-carboxyphenyl)-[1-(2-pyridyl)ethyl]ammonium Formula: C18H19N2O4+ MolecularWeight: 327.35446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[N+](C2=CC=CC(=C2)C(=O)O)(C(=O)C)C(=O)C

Isomeric SMILES

CC(C1=CC=CC=N1)[N+](C2=CC=CC(=C2)C(=O)O)(C(=O)C)C(=O)C

InChI

InChI=1S/C18H18N2O4/c1-12(17-9-4-5-10-19-17)20(13(2)21,14(3)22)16-8-6-7-15(11-16)18(23)24/h4-12H,1-3H3/p+1