N-(4-bromanyl-2,6-diethyl-phenyl)-2,6-diethyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(4-bromanyl-2,6-diethyl-phenyl)-2,6-diethyl-1-oxidanidyl-4-propoxy-pyridin-1-ium-3-carboxamide Openeye Name: N-(4-bromo-2,6-diethyl-phenyl)-2,6-diethyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide CAS Name: N-(4-bromo-2,6-diethylphenyl)-2,6-diethyl-1-oxido-4-propoxy-3-pyridin-1-iumcarboxamide IUPAC Name: N-(4-bromo-2,6-diethylphenyl)-2,6-diethyl-1-oxido-4-propoxypyridin-1-ium-3-carboxamide Traditional Name: N-(4-bromo-2,6-diethyl-phenyl)-2,6-diethyl-1-oxido-4-propoxy-pyridin-1-ium-3-carboxamide Formula: C23H31BrN2O3 MolecularWeight: 463.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=C(C=C2CC)Br)CC)CC)[O-])CC

Isomeric SMILES

CCCOC1=CC(=[N+](C(=C1C(=O)NC2=C(C=C(C=C2CC)Br)CC)CC)[O-])CC

InChI

InChI=1S/C23H31BrN2O3/c1-6-11-29-20-14-18(9-4)26(28)19(10-5)21(20)23(27)25-22-15(7-2)12-17(24)13-16(22)8-3/h12-14H,6-11H2,1-5H3,(H,25,27)