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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

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