5-(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-2,3-dimethoxy-benzenediazonium tetrafluoroborate

Systemtic Name: 5-(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-2,3-dimethoxy-benzenediazonium tetrafluoroborate Openeye Name: 5-(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxo-propyl)-2,3-dimethoxy-benzenediazonium tetrafluoroborate CAS Name: 5-(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,3-dimethoxybenzenediazonium tetrafluoroborate IUPAC Name: 5-(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,3-dimethoxybenzenediazonium tetrafluoroborate Traditional Name: 5-(2-acetamido-2-carbethoxy-3-ethoxy-3-keto-propyl)-2,3-dimethoxy-benzenediazonium tetrafluoroborate Formula: C18H24BF4N3O7 MolecularWeight: 481.203673

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCOC(=O)C(CC1=CC(=C(C(=C1)OC)OC)[N+]#N)(C(=O)OCC)NC(=O)C

Isomeric SMILES

[B-](F)(F)(F)F.CCOC(=O)C(CC1=CC(=C(C(=C1)OC)OC)[N+]#N)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H23N3O7.BF4/c1-6-27-16(23)18(20-11(3)22,17(24)28-7-2)10-12-8-13(21-19)15(26-5)14(9-12)25-4;2-1(3,4)5/h8-9H,6-7,10H2,1-5H3;/q;-1/p+1