(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]methanone Openeye Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (5-chloro-2,3-dihydrobenzofuran-2-yl)-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (5-chloro-2,3-dihydro-1-benzofuran-2-yl)-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: (5-chlorocoumaran-2-yl)-[4-(5-nitrothiophene-2-carbonyl)piperazino]methanone Formula: C18H16ClN3O5S MolecularWeight: 421.85474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC3=C(O2)C=CC(=C3)Cl)C(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2CC3=C(O2)C=CC(=C3)Cl)C(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN3O5S/c19-12-1-2-13-11(9-12)10-14(27-13)17(23)20-5-7-21(8-6-20)18(24)15-3-4-16(28-15)22(25)26/h1-4,9,14H,5-8,10H2