(E)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[2-(tert-butylamino)-2-oxo-ethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-[2-(tert-butylamino)-2-keto-ethyl]-N-ethyl-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)(C)C)C(=O)C=CC1=CC2=C(C=C1[N+](=O)[O-])OCO2

Isomeric SMILES

CCN(CC(=O)NC(C)(C)C)C(=O)/C=C/C1=CC2=C(C=C1[N+](=O)[O-])OCO2

InChI

InChI=1S/C18H23N3O6/c1-5-20(10-16(22)19-18(2,3)4)17(23)7-6-12-8-14-15(27-11-26-14)9-13(12)21(24)25/h6-9H,5,10-11H2,1-4H3,(H,19,22)/b7-6+