(3-chloranyl-4,5-dimethoxy-phenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-(4-pyrrolidinosulfonylpiperazino)methanone Formula: C17H24ClN3O5S MolecularWeight: 417.90756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCC3)Cl)OC

InChI

InChI=1S/C17H24ClN3O5S/c1-25-15-12-13(11-14(18)16(15)26-2)17(22)19-7-9-21(10-8-19)27(23,24)20-5-3-4-6-20/h11-12H,3-10H2,1-2H3