(E)-1-ethoxy-3-ethoxycarbonyl-5-[ethyl(propan-2-yl)azaniumylidene]hex-1-en-1-olate

Systemtic Name: (E)-1-ethoxy-3-ethoxycarbonyl-5-[ethyl(propan-2-yl)azaniumylidene]hex-1-en-1-olate Openeye Name: (E)-1-ethoxy-3-ethoxycarbonyl-5-[ethyl(isopropyl)iminio]hex-1-en-1-olate CAS Name: (E)-1-ethoxy-3-ethoxycarbonyl-5-[ethyl(propan-2-yl)iminio]-1-hexen-1-olate IUPAC Name: (E)-1-ethoxy-3-ethoxycarbonyl-5-[ethyl(propan-2-yl)azaniumylidene]hex-1-en-1-olate Traditional Name: (E)-3-carbethoxy-1-ethoxy-5-[ethyl(isopropyl)iminio]hex-1-en-1-olate Formula: C16H29NO4 MolecularWeight: 299.40576

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C(C)CC(C=C([O-])OCC)C(=O)OCC)C(C)C

Isomeric SMILES

CC[N+](=C(C)CC(/C=C(\[O-])/OCC)C(=O)OCC)C(C)C

InChI

InChI=1S/C16H29NO4/c1-7-17(12(4)5)13(6)10-14(16(19)21-9-3)11-15(18)20-8-2/h11-12,14H,7-10H2,1-6H3/b15-11+,17-13?