[3-(dimethylcarbamoyl)-5-(pyridin-2-ylcarbonylamino)phenyl]methyl-[(4-ethylphenyl)methyl]azanium

Systemtic Name: [3-(dimethylcarbamoyl)-5-(pyridin-2-ylcarbonylamino)phenyl]methyl-[(4-ethylphenyl)methyl]azanium Openeye Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(4-ethylphenyl)methyl]ammonium CAS Name: [3-[dimethylamino(oxo)methyl]-5-[[oxo(2-pyridinyl)methyl]amino]phenyl]methyl-[(4-ethylphenyl)methyl]ammonium IUPAC Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(4-ethylphenyl)methyl]azanium Traditional Name: [3-(dimethylcarbamoyl)-5-picolinamido-benzyl]-(4-ethylbenzyl)ammonium Formula: C25H29N4O2+ MolecularWeight: 417.52336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH2+]CC2=CC(=CC(=C2)C(=O)N(C)C)NC(=O)C3=CC=CC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH2+]CC2=CC(=CC(=C2)C(=O)N(C)C)NC(=O)C3=CC=CC=N3

InChI

InChI=1S/C25H28N4O2/c1-4-18-8-10-19(11-9-18)16-26-17-20-13-21(25(31)29(2)3)15-22(14-20)28-24(30)23-7-5-6-12-27-23/h5-15,26H,4,16-17H2,1-3H3,(H,28,30)/p+1