1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-4-pyrrolidin-1-yl-butane-1,4-dione

Systemtic Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-4-pyrrolidin-1-yl-butane-1,4-dione Openeye Name: 1-[4-(2-naphthylsulfonyl)piperazin-1-yl]-4-pyrrolidin-1-yl-butane-1,4-dione CAS Name: 1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-4-(1-pyrrolidinyl)butane-1,4-dione IUPAC Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-4-pyrrolidin-1-ylbutane-1,4-dione Traditional Name: 1-[4-(2-naphthylsulfonyl)piperazino]-4-pyrrolidino-butane-1,4-dione Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H27N3O4S/c26-21(23-11-3-4-12-23)9-10-22(27)24-13-15-25(16-14-24)30(28,29)20-8-7-18-5-1-2-6-19(18)17-20/h1-2,5-8,17H,3-4,9-16H2