N-[3-(4-chlorophenyl)-5-(4-nitrophenyl)thiophen-2-yl]-1-methyl-piperidin-2-imine

Systemtic Name: N-[3-(4-chlorophenyl)-5-(4-nitrophenyl)thiophen-2-yl]-1-methyl-piperidin-2-imine Openeye Name: N-[3-(4-chlorophenyl)-5-(4-nitrophenyl)-2-thienyl]-1-methyl-piperidin-2-imine CAS Name: N-[3-(4-chlorophenyl)-5-(4-nitrophenyl)-2-thiophenyl]-1-methyl-2-piperidinimine IUPAC Name: N-[3-(4-chlorophenyl)-5-(4-nitrophenyl)thiophen-2-yl]-1-methylpiperidin-2-imine Traditional Name: (E)-[3-(4-chlorophenyl)-5-(4-nitrophenyl)-2-thienyl]-(1-methyl-2-piperidylidene)amine Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC1=NC2=C(C=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CN\1CCCC/C1=N\C2=C(C=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN3O2S/c1-25-13-3-2-4-21(25)24-22-19(15-5-9-17(23)10-6-15)14-20(29-22)16-7-11-18(12-8-16)26(27)28/h5-12,14H,2-4,13H2,1H3/b24-21+