[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Openeye Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-[3-(1-piperidylsulfonyl)phenyl]methanone CAS Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-[3-(1-piperidinylsulfonyl)phenyl]methanone IUPAC Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-(3-piperidin-1-ylsulfonylphenyl)methanone Traditional Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-(3-piperidinosulfonylphenyl)methanone Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCC3C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC[C@H]3C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H28N2O5S/c27-24(19-6-4-7-20(16-19)32(28,29)25-11-2-1-3-12-25)26-13-5-8-21(26)18-9-10-22-23(17-18)31-15-14-30-22/h4,6-7,9-10,16-17,21H,1-3,5,8,11-15H2/t21-/m0/s1