2-chloranyl-3-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-(4-fluorophenyl)sulfonylpiperazino]-1,4-naphthoquinone Formula: C20H16ClFN2O4S MolecularWeight: 434.868443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H16ClFN2O4S/c21-17-18(20(26)16-4-2-1-3-15(16)19(17)25)23-9-11-24(12-10-23)29(27,28)14-7-5-13(22)6-8-14/h1-8H,9-12H2