methyl 4-phenyl-1-(phenylmethyl)sulfonyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-phenyl-1-(phenylmethyl)sulfonyl-piperidine-4-carboxylate Openeye Name: methyl 1-benzylsulfonyl-4-phenyl-piperidine-4-carboxylate CAS Name: 4-phenyl-1-(phenylmethyl)sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-benzylsulfonyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-benzylsulfonyl-4-phenyl-isonipecotic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)S(=O)(=O)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCN(CC1)S(=O)(=O)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S/c1-25-19(22)20(18-10-6-3-7-11-18)12-14-21(15-13-20)26(23,24)16-17-8-4-2-5-9-17/h2-11H,12-16H2,1H3