ethyl (E)-7-[(2-iodanylphenyl)methyl-(phenylcarbonyl)amino]hept-2-enoate

Systemtic Name: ethyl (E)-7-[(2-iodanylphenyl)methyl-(phenylcarbonyl)amino]hept-2-enoate Openeye Name: ethyl (E)-7-[benzoyl-[(2-iodophenyl)methyl]amino]hept-2-enoate CAS Name: (E)-7-[benzoyl-[(2-iodophenyl)methyl]amino]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[benzoyl-[(2-iodophenyl)methyl]amino]hept-2-enoate Traditional Name: (E)-7-[benzoyl-(2-iodobenzyl)amino]hept-2-enoic acid ethyl ester Formula: C23H26INO3 MolecularWeight: 491.36191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCCN(CC1=CC=CC=C1I)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/CCCCN(CC1=CC=CC=C1I)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H26INO3/c1-2-28-22(26)16-8-3-4-11-17-25(18-20-14-9-10-15-21(20)24)23(27)19-12-6-5-7-13-19/h5-10,12-16H,2-4,11,17-18H2,1H3/b16-8+