[3-chloranyl-7-nitro-5,6-bis(oxidanyl)-1-benzothiophen-2-yl]-(4-oxidanylpiperidin-1-yl)methanone

Systemtic Name: [3-chloranyl-7-nitro-5,6-bis(oxidanyl)-1-benzothiophen-2-yl]-(4-oxidanylpiperidin-1-yl)methanone Openeye Name: (3-chloro-5,6-dihydroxy-7-nitro-benzothiophen-2-yl)-(4-hydroxy-1-piperidyl)methanone CAS Name: (3-chloro-5,6-dihydroxy-7-nitro-1-benzothiophen-2-yl)-(4-hydroxy-1-piperidinyl)methanone IUPAC Name: (3-chloro-5,6-dihydroxy-7-nitro-1-benzothiophen-2-yl)-(4-hydroxypiperidin-1-yl)methanone Traditional Name: (3-chloro-5,6-dihydroxy-7-nitro-benzothiophen-2-yl)-(4-hydroxypiperidino)methanone Formula: C14H13ClN2O6S MolecularWeight: 372.78082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)C2=C(C3=CC(=C(C(=C3S2)[N+](=O)[O-])O)O)Cl

Isomeric SMILES

C1CN(CCC1O)C(=O)C2=C(C3=CC(=C(C(=C3S2)[N+](=O)[O-])O)O)Cl

InChI

InChI=1S/C14H13ClN2O6S/c15-9-7-5-8(19)11(20)10(17(22)23)12(7)24-13(9)14(21)16-3-1-6(18)2-4-16/h5-6,18-20H,1-4H2