N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(4-nitrophenoxy)acetamide Formula: C19H23N4O4+ MolecularWeight: 371.41032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-21-10-12-22(13-11-21)16-4-2-15(3-5-16)20-19(24)14-27-18-8-6-17(7-9-18)23(25)26/h2-9H,10-14H2,1H3,(H,20,24)/p+1