(2-acetamidophenyl)carbonyl-(2-aminophenyl)-(pyridin-3-ylcarbonylamino)-(pyridin-3-ylmethyl)azanium

Systemtic Name: (2-acetamidophenyl)carbonyl-(2-aminophenyl)-(pyridin-3-ylcarbonylamino)-(pyridin-3-ylmethyl)azanium Openeye Name: (2-acetamidobenzoyl)-(2-aminophenyl)-(pyridine-3-carbonylamino)-(3-pyridylmethyl)ammonium CAS Name: [(2-acetamidophenyl)-oxomethyl]-(2-aminophenyl)-[[oxo(3-pyridinyl)methyl]amino]-(3-pyridinylmethyl)ammonium IUPAC Name: (2-acetamidobenzoyl)-(2-aminophenyl)-(pyridine-3-carbonylamino)-(pyridin-3-ylmethyl)azanium Traditional Name: (2-acetamidobenzoyl)-(2-aminophenyl)-nicotinamido-(3-pyridylmethyl)ammonium Formula: C27H25N6O3+ MolecularWeight: 481.5258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1C(=O)[N+](CC2=CN=CC=C2)(C3=CC=CC=C3N)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=CC=C1C(=O)[N+](CC2=CN=CC=C2)(C3=CC=CC=C3N)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H24N6O3/c1-19(34)31-24-12-4-2-10-22(24)27(36)33(18-20-8-6-14-29-16-20,25-13-5-3-11-23(25)28)32-26(35)21-9-7-15-30-17-21/h2-17H,18,28H2,1H3,(H-,31,32,34,35,36)/p+1