N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C15H15BrN2O3 MolecularWeight: 351.1952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C2=C[N+](=CC=C2)[O-]

InChI

InChI=1S/C15H15BrN2O3/c1-10(11-5-6-14(21-2)13(16)8-11)17-15(19)12-4-3-7-18(20)9-12/h3-10H,1-2H3,(H,17,19)