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

Systemtic Name: 1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazino]-2-phenoxy-ethanone Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC=C2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC=C2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c21-15(12-25-13-4-2-1-3-5-13)18-8-10-19(11-9-18)17(22)14-6-7-16(26-14)20(23)24/h1-7H,8-12H2