(4-nitrophenyl)-[4-[2-(5-nitrothiophen-2-yl)ethyl]piperazin-1-yl]methanone

Systemtic Name: (4-nitrophenyl)-[4-[2-(5-nitrothiophen-2-yl)ethyl]piperazin-1-yl]methanone Openeye Name: (4-nitrophenyl)-[4-[2-(5-nitro-2-thienyl)ethyl]piperazin-1-yl]methanone CAS Name: (4-nitrophenyl)-[4-[2-(5-nitro-2-thiophenyl)ethyl]-1-piperazinyl]methanone IUPAC Name: (4-nitrophenyl)-[4-[2-(5-nitrothiophen-2-yl)ethyl]piperazin-1-yl]methanone Traditional Name: (4-nitrophenyl)-[4-[2-(5-nitro-2-thienyl)ethyl]piperazino]methanone Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S/c22-17(13-1-3-14(4-2-13)20(23)24)19-11-9-18(10-12-19)8-7-15-5-6-16(27-15)21(25)26/h1-6H,7-12H2