(2S)-1-(5-bromanyl-2-methoxy-phenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine

Systemtic Name: (2S)-1-(5-bromanyl-2-methoxy-phenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine Openeye Name: (2S)-1-(5-bromo-2-methoxy-phenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine CAS Name: (2S)-1-(5-bromo-2-methoxyphenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine IUPAC Name: (2S)-1-(5-bromo-2-methoxyphenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine Traditional Name: (2S)-1-(5-bromo-2-methoxy-phenyl)sulfonyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine Formula: C19H20BrNO5S MolecularWeight: 454.3348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H20BrNO5S/c1-24-17-7-5-14(20)12-19(17)27(22,23)21-8-2-3-15(21)13-4-6-16-18(11-13)26-10-9-25-16/h4-7,11-12,15H,2-3,8-10H2,1H3/t15-/m0/s1