(E)-N-(4-methylpiperazin-4-ium-1-yl)-3-(2-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-(2-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-(2-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(4-methyl-1-piperazin-4-iumyl)-3-(2-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-(2-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-(2-nitrophenyl)acrylamide Formula: C14H19N4O3+ MolecularWeight: 291.32566

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O3/c1-16-8-10-17(11-9-16)15-14(19)7-6-12-4-2-3-5-13(12)18(20)21/h2-7H,8-11H2,1H3,(H,15,19)/p+1/b7-6+