1,4-bis(chloranyl)-7-pyrrolidin-1-ylsulfonyl-isoquinoline; pyrrolidine

Systemtic Name: 1,4-bis(chloranyl)-7-pyrrolidin-1-ylsulfonyl-isoquinoline; pyrrolidine Openeye Name: 1,4-dichloro-7-pyrrolidin-1-ylsulfonyl-isoquinoline; pyrrolidine CAS Name: 1,4-dichloro-7-(1-pyrrolidinylsulfonyl)isoquinoline; pyrrolidine IUPAC Name: 1,4-dichloro-7-pyrrolidin-1-ylsulfonylisoquinoline; pyrrolidine Traditional Name: 1,4-dichloro-7-pyrrolidinosulfonyl-isoquinoline; pyrrolidine Formula: C17H21Cl2N3O2S MolecularWeight: 402.33854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC1.C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

Isomeric SMILES

C1CCNC1.C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O2S.C4H9N/c14-12-8-16-13(15)11-7-9(3-4-10(11)12)20(18,19)17-5-1-2-6-17;1-2-4-5-3-1/h3-4,7-8H,1-2,5-6H2;5H,1-4H2