N-ethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-ethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-ethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: N-ethyl-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-ethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-ethyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-N-(2-thenyl)acetamide Formula: C19H25N4O3S+ MolecularWeight: 389.4918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC=CS1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O3S/c1-2-21(14-18-4-3-13-27-18)19(24)15-20-9-11-22(12-10-20)16-5-7-17(8-6-16)23(25)26/h3-8,13H,2,9-12,14-15H2,1H3/p+1