(E)-N-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(4-methyl-1-piperazinyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(4-methylpiperazin-1-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(4-methylpiperazino)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C15H18N4O5 MolecularWeight: 334.32722

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CN1CCN(CC1)NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C15H18N4O5/c1-17-4-6-18(7-5-17)16-15(20)3-2-11-8-13-14(24-10-23-13)9-12(11)19(21)22/h2-3,8-9H,4-7,10H2,1H3,(H,16,20)/b3-2+