1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylazepane

Systemtic Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylazepane Openeye Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylazepane CAS Name: 1-[[(2R)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]sulfonyl]azepane IUPAC Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonylazepane Traditional Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)pyrrolidino]sulfonylazepane Formula: C18H28N2O4S MolecularWeight: 368.49092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CCCN2S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C18H28N2O4S/c1-23-17-10-9-15(14-18(17)24-2)16-8-7-13-20(16)25(21,22)19-11-5-3-4-6-12-19/h9-10,14,16H,3-8,11-13H2,1-2H3/t16-/m1/s1