ethyl (3S)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperidine-3-carboxylate CAS Name: (3S)-1-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: (3S)-1-[4-(2-ketopyrrolidino)phenyl]sulfonylnipecotic acid ethyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C18H24N2O5S/c1-2-25-18(22)14-5-3-11-19(13-14)26(23,24)16-9-7-15(8-10-16)20-12-4-6-17(20)21/h7-10,14H,2-6,11-13H2,1H3/t14-/m0/s1