(phenylmethyl) 4-isocyanato-4-phenyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-isocyanato-4-phenyl-piperidine-1-carboxylate Openeye Name: benzyl 4-isocyanato-4-phenyl-piperidine-1-carboxylate CAS Name: 4-isocyanato-4-phenyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-isocyanato-4-phenylpiperidine-1-carboxylate Traditional Name: 4-isocyanato-4-phenyl-piperidine-1-carboxylic acid benzyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O3/c23-16-21-20(18-9-5-2-6-10-18)11-13-22(14-12-20)19(24)25-15-17-7-3-1-4-8-17/h1-10H,11-15H2