(4-fluoranyl-1-benzothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-fluoranyl-1-benzothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-fluorobenzothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-fluoro-1-benzothiophen-2-yl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-fluoro-1-benzothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-fluorobenzothiophen-2-yl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C19H16FN3O3S MolecularWeight: 385.412043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C19H16FN3O3S/c20-16-2-1-3-17-15(16)12-18(27-17)19(24)22-10-8-21(9-11-22)13-4-6-14(7-5-13)23(25)26/h1-7,12H,8-11H2