4-[[(3S)-1-(4-tert-butylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoyl chloride

Systemtic Name: 4-[[(3S)-1-(4-tert-butylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoyl chloride Openeye Name: 4-[[(3S)-1-(4-tert-butylphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoyl chloride CAS Name: 4-[[(3S)-1-(4-tert-butylphenyl)-5-oxo-3-pyrrolidinyl]methoxy]benzoyl chloride IUPAC Name: 4-[[(3S)-1-(4-tert-butylphenyl)-5-oxopyrrolidin-3-yl]methoxy]benzoyl chloride Traditional Name: 4-[[(3S)-1-(4-tert-butylphenyl)-5-keto-pyrrolidin-3-yl]methoxy]benzoyl chloride Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C[C@H](CC2=O)COC3=CC=C(C=C3)C(=O)Cl

InChI

InChI=1S/C22H24ClNO3/c1-22(2,3)17-6-8-18(9-7-17)24-13-15(12-20(24)25)14-27-19-10-4-16(5-11-19)21(23)26/h4-11,15H,12-14H2,1-3H3/t15-/m0/s1