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

Systemtic Name: [3-(dimethylcarbamoyl)-5-(pyridin-2-ylcarbonylamino)phenyl]methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(4-isopropylphenyl)methyl]ammonium CAS Name: [3-[dimethylamino(oxo)methyl]-5-[[oxo(2-pyridinyl)methyl]amino]phenyl]methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [3-(dimethylcarbamoyl)-5-picolinamido-benzyl]-(4-isopropylbenzyl)ammonium Formula: C26H31N4O2+ MolecularWeight: 431.54994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N4O2/c1-18(2)21-10-8-19(9-11-21)16-27-17-20-13-22(26(32)30(3)4)15-23(14-20)29-25(31)24-7-5-6-12-28-24/h5-15,18,27H,16-17H2,1-4H3,(H,29,31)/p+1