2-oxidanylidenepropyl 1-(3-ethanoylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: 2-oxidanylidenepropyl 1-(3-ethanoylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate Openeye Name: acetonyl 1-(3-acetylphenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-(3-acetylphenyl)sulfonyl-4-phenyl-4-piperidinecarboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 1-(3-acetylphenyl)sulfonyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-(3-acetylphenyl)sulfonyl-4-phenyl-isonipecotic acid acetonyl ester Formula: C23H25NO6S MolecularWeight: 443.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)COC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO6S/c1-17(25)16-30-22(27)23(20-8-4-3-5-9-20)11-13-24(14-12-23)31(28,29)21-10-6-7-19(15-21)18(2)26/h3-10,15H,11-14,16H2,1-2H3