azanium tert-butyl (E)-3-cyano-5-methyl-hex-3-enoate

Systemtic Name: azanium tert-butyl (E)-3-cyano-5-methyl-hex-3-enoate Openeye Name: ammonium tert-butyl (E)-3-cyano-5-methyl-hex-3-enoate CAS Name: ammonium (E)-3-cyano-5-methyl-3-hexenoic acid tert-butyl ester IUPAC Name: azanium tert-butyl (E)-3-cyano-5-methylhex-3-enoate Traditional Name: ammonium (E)-3-cyano-5-methyl-hex-3-enoic acid tert-butyl ester Formula: C12H23N2O2+ MolecularWeight: 227.32322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=C(CC(=O)OC(C)(C)C)C#N.[NH4+]

Isomeric SMILES

CC(C)/C=C(\CC(=O)OC(C)(C)C)/C#N.[NH4+]

InChI

InChI=1S/C12H19NO2.H3N/c1-9(2)6-10(8-13)7-11(14)15-12(3,4)5;/h6,9H,7H2,1-5H3;1H3/p+1/b10-6+;