ethyl 4-(3-phenylpropyl)-1-propylsulfonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-(3-phenylpropyl)-1-propylsulfonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(3-phenylpropyl)-1-propylsulfonyl-piperidine-4-carboxylate CAS Name: 4-(3-phenylpropyl)-1-propylsulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenylpropyl)-1-propylsulfonylpiperidine-4-carboxylate Traditional Name: 4-(3-phenylpropyl)-1-propylsulfonyl-isonipecotic acid ethyl ester Formula: C20H31NO4S MolecularWeight: 381.52944

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)(CCCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)(CCCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H31NO4S/c1-3-17-26(23,24)21-15-13-20(14-16-21,19(22)25-4-2)12-8-11-18-9-6-5-7-10-18/h5-7,9-10H,3-4,8,11-17H2,1-2H3