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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-nitrobenzamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3/c1-2-21-10-12-22(13-11-21)17-8-6-16(7-9-17)20-19(24)15-4-3-5-18(14-15)23(25)26/h3-9,14H,2,10-13H2,1H3,(H,20,24)/p+1