2-(4-chlorophenyl)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)-1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenyl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-(4-chlorophenyl)-1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenyl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-chlorophenyl)-1-[4-(5-nitrothiophene-2-carbonyl)piperazino]ethanone Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)Cl)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)Cl)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4S/c18-13-3-1-12(2-4-13)11-15(22)19-7-9-20(10-8-19)17(23)14-5-6-16(26-14)21(24)25/h1-6H,7-11H2