1-naphthalen-2-ylsulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-naphthalen-2-ylsulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Openeye Name: 1-(2-naphthylsulfonyl)-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine CAS Name: 1-(2-naphthalenylsulfonyl)-4-[5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-naphthalen-2-ylsulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Traditional Name: 1-(2-naphthylsulfonyl)-4-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)piperazine Formula: C23H27N4O4S2+ MolecularWeight: 487.61488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C23H26N4O4S2/c28-32(29,21-8-7-19-5-1-2-6-20(19)17-21)27-15-13-25(14-16-27)23-10-9-22(18-24-23)33(30,31)26-11-3-4-12-26/h1-2,5-10,17-18H,3-4,11-16H2/p+1