[(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-3-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]-3-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3S)-1-[(2,4-dichlorophenyl)methylsulfonyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3S)-1-(2,4-dichlorobenzyl)sulfonyl-3-piperidyl]-pyrrolidino-methanone Formula: C17H22Cl2N2O3S MolecularWeight: 405.33918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H22Cl2N2O3S/c18-15-6-5-14(16(19)10-15)12-25(23,24)21-9-3-4-13(11-21)17(22)20-7-1-2-8-20/h5-6,10,13H,1-4,7-9,11-12H2/t13-/m0/s1