N-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(4-ethyl-1-piperazin-4-iumyl)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(4-ethylpiperazin-4-ium-1-yl)-3-keto-propyl]-4-nitro-benzamide Formula: C16H23N4O4+ MolecularWeight: 335.37822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4O4/c1-2-18-9-11-19(12-10-18)15(21)7-8-17-16(22)13-3-5-14(6-4-13)20(23)24/h3-6H,2,7-12H2,1H3,(H,17,22)/p+1