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

Systemtic Name: 4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzamide Openeye Name: 4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzamide CAS Name: 4-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]sulfonyl]benzamide IUPAC Name: 4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzamide Traditional Name: 4-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]sulfonylbenzamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H20N2O5S/c20-19(22)13-3-6-15(7-4-13)27(23,24)21-9-1-2-16(21)14-5-8-17-18(12-14)26-11-10-25-17/h3-8,12,16H,1-2,9-11H2,(H2,20,22)/t16-/m0/s1