ethyl (3S)-3-[(3-methoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-3-[(3-methoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxylate Openeye Name: ethyl (3S)-3-[(3-methoxyphenyl)methyl]-1-methylsulfonyl-piperidine-3-carboxylate CAS Name: (3S)-3-[(3-methoxyphenyl)methyl]-1-methylsulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-[(3-methoxyphenyl)methyl]-1-methylsulfonylpiperidine-3-carboxylate Traditional Name: (3S)-3-m-anisyl-1-mesyl-nipecotic acid ethyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)S(=O)(=O)C)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)S(=O)(=O)C)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C17H25NO5S/c1-4-23-16(19)17(9-6-10-18(13-17)24(3,20)21)12-14-7-5-8-15(11-14)22-2/h5,7-8,11H,4,6,9-10,12-13H2,1-3H3/t17-/m0/s1