1-[4-(1,3-dithiolan-2-yl)-2-nitro-phenyl]-4-(4-methoxyphenyl)piperazine

Systemtic Name: 1-[4-(1,3-dithiolan-2-yl)-2-nitro-phenyl]-4-(4-methoxyphenyl)piperazine Openeye Name: 1-[4-(1,3-dithiolan-2-yl)-2-nitro-phenyl]-4-(4-methoxyphenyl)piperazine CAS Name: 1-[4-(1,3-dithiolan-2-yl)-2-nitrophenyl]-4-(4-methoxyphenyl)piperazine IUPAC Name: 1-[4-(1,3-dithiolan-2-yl)-2-nitrophenyl]-4-(4-methoxyphenyl)piperazine Traditional Name: 1-[4-(1,3-dithiolan-2-yl)-2-nitro-phenyl]-4-(4-methoxyphenyl)piperazine Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)C4SCCS4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)C4SCCS4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O3S2/c1-26-17-5-3-16(4-6-17)21-8-10-22(11-9-21)18-7-2-15(14-19(18)23(24)25)20-27-12-13-28-20/h2-7,14,20H,8-13H2,1H3