N-(4-butylphenyl)-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(4-butylphenyl)-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(4-butylphenyl)-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(4-butylphenyl)-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(4-butylphenyl)-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(4-butylphenyl)-1-oxido-pyridin-1-ium-3-carboxamide Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)[O-]

InChI

InChI=1S/C16H18N2O2/c1-2-3-5-13-7-9-15(10-8-13)17-16(19)14-6-4-11-18(20)12-14/h4,6-12H,2-3,5H2,1H3,(H,17,19)