N-(2,6-diethylphenyl)-6-methyl-4-(2-methylpropoxy)-1-oxidanidyl-2-phenyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-6-methyl-4-(2-methylpropoxy)-1-oxidanidyl-2-phenyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(2,6-diethylphenyl)-4-isobutoxy-6-methyl-1-oxido-2-phenyl-pyridin-1-ium-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-6-methyl-4-(2-methylpropoxy)-1-oxido-2-phenyl-3-pyridin-1-iumcarboxamide IUPAC Name: N-(2,6-diethylphenyl)-6-methyl-4-(2-methylpropoxy)-1-oxido-2-phenylpyridin-1-ium-3-carboxamide Traditional Name: N-(2,6-diethylphenyl)-4-isobutoxy-6-methyl-1-oxido-2-phenyl-pyridin-1-ium-3-carboxamide Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC(C)C)C)[O-])C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C([N+](=C(C=C2OCC(C)C)C)[O-])C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O3/c1-6-20-14-11-15-21(7-2)25(20)28-27(30)24-23(32-17-18(3)4)16-19(5)29(31)26(24)22-12-9-8-10-13-22/h8-16,18H,6-7,17H2,1-5H3,(H,28,30)