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

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxy-3-nitro-phenyl)sulfonyl-pyrrolidine Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxy-3-nitro-phenyl)sulfonyl-pyrrolidine CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxy-3-nitrophenyl)sulfonylpyrrolidine IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxy-3-nitrophenyl)sulfonylpyrrolidine Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxy-3-nitro-phenyl)sulfonyl-pyrrolidine Formula: C19H20N2O7S MolecularWeight: 420.4363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O7S/c1-26-17-7-5-14(12-16(17)21(22)23)29(24,25)20-8-2-3-15(20)13-4-6-18-19(11-13)28-10-9-27-18/h4-7,11-12,15H,2-3,8-10H2,1H3/t15-/m0/s1