ethyl 4-(4-phenylmethoxyphenyl)sulfonyl-1-(phenylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-(4-phenylmethoxyphenyl)sulfonyl-1-(phenylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-benzyl-4-(4-benzyloxyphenyl)sulfonyl-piperidine-4-carboxylate CAS Name: 4-(4-phenylmethoxyphenyl)sulfonyl-1-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(4-phenylmethoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 4-(4-benzoxyphenyl)sulfonyl-1-benzyl-isonipecotic acid ethyl ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H31NO5S/c1-2-33-27(30)28(17-19-29(20-18-28)21-23-9-5-3-6-10-23)35(31,32)26-15-13-25(14-16-26)34-22-24-11-7-4-8-12-24/h3-16H,2,17-22H2,1H3