(E)-3-(5-nitrofuran-2-yl)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]prop-2-enamide

Systemtic Name: (E)-3-(5-nitrofuran-2-yl)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]prop-2-enamide Openeye Name: (E)-N-[2-(isopropylamino)-2-oxo-ethyl]-3-(5-nitro-2-furyl)prop-2-enamide CAS Name: (E)-3-(5-nitro-2-furanyl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-propenamide IUPAC Name: (E)-3-(5-nitrofuran-2-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]prop-2-enamide Traditional Name: (E)-N-[2-(isopropylamino)-2-keto-ethyl]-3-(5-nitro-2-furyl)acrylamide Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C=CC1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CNC(=O)/C=C/C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c1-8(2)14-11(17)7-13-10(16)5-3-9-4-6-12(20-9)15(18)19/h3-6,8H,7H2,1-2H3,(H,13,16)(H,14,17)/b5-3+