N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-(5-nitrothiophen-2-yl)methanimine

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-(5-nitrothiophen-2-yl)methanimine Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-(5-nitro-2-thienyl)methanimine CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-1-(5-nitro-2-thiophenyl)methanimine IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-(5-nitrothiophen-2-yl)methanimine Traditional Name: [4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-[(5-nitro-2-thienyl)methylene]amine Formula: C17H21N4O2S+ MolecularWeight: 345.43924

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)N=CC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)N=CC3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O2S/c1-2-19-9-11-20(12-10-19)15-5-3-14(4-6-15)18-13-16-7-8-17(24-16)21(22)23/h3-8,13H,2,9-12H2,1H3/p+1