[4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(1,3-dithiolan-2-yl)phenyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C20H21N3O3S2/c24-19(15-1-3-16(4-2-15)20-27-13-14-28-20)22-11-9-21(10-12-22)17-5-7-18(8-6-17)23(25)26/h1-8,20H,9-14H2