4-[(E)-C-[3-bromanyl-5-(methoxymethyl)thiophen-2-yl]-N-oxidanyl-carbonimidoyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[(E)-C-[3-bromanyl-5-(methoxymethyl)thiophen-2-yl]-N-oxidanyl-carbonimidoyl]piperidine-1-carboxylic acid Openeye Name: 4-[(E)-C-[3-bromo-5-(methoxymethyl)-2-thienyl]-N-hydroxy-carbonimidoyl]piperidine-1-carboxylic acid CAS Name: 4-[(E)-[3-bromo-5-(methoxymethyl)-2-thiophenyl]-hydroxyiminomethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[(E)-C-[3-bromo-5-(methoxymethyl)thiophen-2-yl]-N-hydroxycarbonimidoyl]piperidine-1-carboxylic acid Traditional Name: 4-[(E)-[3-bromo-5-(methoxymethyl)-2-thienyl]carbohydroximoyl]piperidine-1-carboxylic acid Formula: C13H17BrN2O4S MolecularWeight: 377.25408

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=C(S1)C(=NO)C2CCN(CC2)C(=O)O)Br

Isomeric SMILES

COCC1=CC(=C(S1)/C(=N/O)/C2CCN(CC2)C(=O)O)Br

InChI

InChI=1S/C13H17BrN2O4S/c1-20-7-9-6-10(14)12(21-9)11(15-19)8-2-4-16(5-3-8)13(17)18/h6,8,19H,2-5,7H2,1H3,(H,17,18)/b15-11+