(phenylmethyl) 4-(4-chloranyl-2,3,5,6-tetradeuterio-phenyl)-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-chloranyl-2,3,5,6-tetradeuterio-phenyl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: benzyl 4-(4-chloro-2,3,5,6-tetradeuterio-phenyl)-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxy-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-(4-chloro-2,3,5,6-tetradeuterio-phenyl)-4-hydroxy-piperidine-1-carboxylic acid benzyl ester Formula: C19H20ClNO3 MolecularWeight: 349.844647

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1C2(CCN(CC2)C(=O)OCC3=CC=CC=C3)O)[2H])[2H])Cl)[2H]

InChI

InChI=1S/C19H20ClNO3/c20-17-8-6-16(7-9-17)19(23)10-12-21(13-11-19)18(22)24-14-15-4-2-1-3-5-15/h1-9,23H,10-14H2/i6D,7D,8D,9D