1-[5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonylthiophen-2-yl]ethanone

Systemtic Name: 1-[5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonylthiophen-2-yl]ethanone Openeye Name: 1-[5-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-2-thienyl]ethanone CAS Name: 1-[5-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-2-thienyl]ethanone Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4S/c1-11(22)15-4-5-16(26-15)17(23)20-8-6-19(7-9-20)13-3-2-12(18)10-14(13)21(24)25/h2-5,10H,6-9H2,1H3