(phenylmethyl) 4-[4-chloranyl-2-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[4-chloranyl-2-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]phenyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[4-chloro-2-[(E)-N-hydroxy-C-methyl-carbonimidoyl]phenyl]piperidine-1-carboxylate CAS Name: 4-[4-chloro-2-[(1E)-1-hydroxyiminoethyl]phenyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-chloro-2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]piperidine-1-carboxylate Traditional Name: 4-(2-acetohydroximoyl-4-chloro-phenyl)piperidine-1-carboxylic acid benzyl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C1=C(C=CC(=C1)Cl)C2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C/C(=N\O)/C1=C(C=CC(=C1)Cl)C2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN2O3/c1-15(23-26)20-13-18(22)7-8-19(20)17-9-11-24(12-10-17)21(25)27-14-16-5-3-2-4-6-16/h2-8,13,17,26H,9-12,14H2,1H3/b23-15+