[3-(dimethylcarbamoyl)-5-(pyridin-2-ylcarbonylamino)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: [3-(dimethylcarbamoyl)-5-(pyridin-2-ylcarbonylamino)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(1R)-1-methyl-3-phenyl-propyl]ammonium CAS Name: [3-[dimethylamino(oxo)methyl]-5-[[oxo(2-pyridinyl)methyl]amino]phenyl]methyl-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: [3-(dimethylcarbamoyl)-5-(pyridine-2-carbonylamino)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: [3-(dimethylcarbamoyl)-5-picolinamido-benzyl]-[(1R)-1-methyl-3-phenyl-propyl]ammonium Formula: C26H31N4O2+ MolecularWeight: 431.54994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N4O2/c1-19(12-13-20-9-5-4-6-10-20)28-18-21-15-22(26(32)30(2)3)17-23(16-21)29-25(31)24-11-7-8-14-27-24/h4-11,14-17,19,28H,12-13,18H2,1-3H3,(H,29,31)/p+1/t19-/m1/s1