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

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-(4-nitrophenoxy)acetamide Formula: C19H23N4O6S+ MolecularWeight: 435.47412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O6S/c1-21-10-12-22(13-11-21)30(27,28)18-8-2-15(3-9-18)20-19(24)14-29-17-6-4-16(5-7-17)23(25)26/h2-9H,10-14H2,1H3,(H,20,24)/p+1