Specification
Synonyms
[2-[N-(carboxymethyl)-C-methylcarbonimidoyl]phenyl]-(pyridine-2-carbonyl)azanide;nickel
IUPAC Name
[2-[N-(carboxymethyl)-C-methylcarbonimidoyl]phenyl]-(pyridine-2-carbonyl)azanide;nickel;
Canonical SMILES
CC(=NCC(=O)O)C1=CC=CC=C1[N-]C(=O)C2=CC=CC=N2.[Ni]
InChI
InChI=1S/C16H15N3O3.Ni/c1-11(18-10-15(20)21)12-6-2-3-7-13(12)19-16(22)14-8-4-5-9-17-14;/h2-9H,10H2,1H3,(H2,18,19,20,21,22);/p-1
InChI Key
FWLGSJHKMDCFKF-UHFFFAOYSA-M
Covalently-Bonded Unit Count
2
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
1
Monoisotopic Mass
354.038858
Topological Polar Surface Area
80.6 Ų