1-oxidanidyl-N'-(4-propan-2-yloxyphenyl)carbonyl-pyridin-1-ium-3-carbohydrazide

Systemtic Name: 1-oxidanidyl-N'-(4-propan-2-yloxyphenyl)carbonyl-pyridin-1-ium-3-carbohydrazide Openeye Name: N'-(4-isopropoxybenzoyl)-1-oxido-pyridin-1-ium-3-carbohydrazide CAS Name: 1-oxido-N'-[oxo-(4-propan-2-yloxyphenyl)methyl]-3-pyridin-1-iumcarbohydrazide IUPAC Name: 1-oxido-N'-(4-propan-2-yloxybenzoyl)pyridin-1-ium-3-carbohydrazide Traditional Name: N'-(4-isopropoxybenzoyl)-1-oxido-pyridin-1-ium-3-carbohydrazide Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NNC(=O)C2=C[N+](=CC=C2)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NNC(=O)C2=C[N+](=CC=C2)[O-]

InChI

InChI=1S/C16H17N3O4/c1-11(2)23-14-7-5-12(6-8-14)15(20)17-18-16(21)13-4-3-9-19(22)10-13/h3-11H,1-2H3,(H,17,20)(H,18,21)