[4-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone

Systemtic Name: [4-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Openeye Name: [4-(5-chlorobenzofuran-2-carbonyl)piperazin-1-yl]-(5-nitro-2-thienyl)methanone CAS Name: [4-[(5-chloro-2-benzofuranyl)-oxomethyl]-1-piperazinyl]-(5-nitro-2-thiophenyl)methanone IUPAC Name: [4-(5-chloro-1-benzofuran-2-carbonyl)piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Traditional Name: [4-(5-chlorobenzofuran-2-carbonyl)piperazino]-(5-nitro-2-thienyl)methanone Formula: C18H14ClN3O5S MolecularWeight: 419.83886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C18H14ClN3O5S/c19-12-1-2-13-11(9-12)10-14(27-13)17(23)20-5-7-21(8-6-20)18(24)15-3-4-16(28-15)22(25)26/h1-4,9-10H,5-8H2