ethyl (3S)-1-[2-(4-morpholin-4-ylsulfonylphenoxy)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-(4-morpholin-4-ylsulfonylphenoxy)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-(4-morpholinosulfonylphenoxy)acetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[4-(4-morpholinylsulfonyl)phenoxy]-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-(4-morpholin-4-ylsulfonylphenoxy)acetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-(4-morpholinosulfonylphenoxy)acetyl]nipecotic acid ethyl ester Formula: C20H28N2O7S MolecularWeight: 440.51052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H28N2O7S/c1-2-28-20(24)16-4-3-9-21(14-16)19(23)15-29-17-5-7-18(8-6-17)30(25,26)22-10-12-27-13-11-22/h5-8,16H,2-4,9-15H2,1H3/t16-/m0/s1