ethyl (E)-8-[tert-butyl-(2-iodanylphenyl)carbonyl-amino]oct-2-enoate

Systemtic Name: ethyl (E)-8-[tert-butyl-(2-iodanylphenyl)carbonyl-amino]oct-2-enoate Openeye Name: ethyl (E)-8-[tert-butyl-(2-iodobenzoyl)amino]oct-2-enoate CAS Name: (E)-8-[tert-butyl-[(2-iodophenyl)-oxomethyl]amino]-2-octenoic acid ethyl ester IUPAC Name: ethyl (E)-8-[tert-butyl-(2-iodobenzoyl)amino]oct-2-enoate Traditional Name: (E)-8-[tert-butyl-(2-iodobenzoyl)amino]oct-2-enoic acid ethyl ester Formula: C21H30INO3 MolecularWeight: 471.37227

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCCCN(C(=O)C1=CC=CC=C1I)C(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/CCCCCN(C(=O)C1=CC=CC=C1I)C(C)(C)C

InChI

InChI=1S/C21H30INO3/c1-5-26-19(24)15-9-7-6-8-12-16-23(21(2,3)4)20(25)17-13-10-11-14-18(17)22/h9-11,13-15H,5-8,12,16H2,1-4H3/b15-9+