dimethyl 2-[(E)-1-iodanylhex-1-en-2-yl]-2-(phenylmethyl)propanedioate

Systemtic Name: dimethyl 2-[(E)-1-iodanylhex-1-en-2-yl]-2-(phenylmethyl)propanedioate Openeye Name: dimethyl 2-benzyl-2-[(1E)-1-(iodomethylene)pentyl]propanedioate CAS Name: 2-[(E)-1-iodohex-1-en-2-yl]-2-(phenylmethyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-benzyl-2-[(E)-1-iodohex-1-en-2-yl]propanedioate Traditional Name: 2-benzyl-2-[(E)-1-butyl-2-iodo-vinyl]malonic acid dimethyl ester Formula: C18H23IO4 MolecularWeight: 430.27729

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CI)C(CC1=CC=CC=C1)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCCC/C(=C\I)/C(CC1=CC=CC=C1)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H23IO4/c1-4-5-11-15(13-19)18(16(20)22-2,17(21)23-3)12-14-9-7-6-8-10-14/h6-10,13H,4-5,11-12H2,1-3H3/b15-13+