ethyl (2Z)-2-cyano-2-[2-[(4-iodophenyl)methyl]-3-oxidanylidene-isoindol-1-ylidene]ethanoate

Systemtic Name: ethyl (2Z)-2-cyano-2-[2-[(4-iodophenyl)methyl]-3-oxidanylidene-isoindol-1-ylidene]ethanoate Openeye Name: ethyl (2Z)-2-cyano-2-[2-[(4-iodophenyl)methyl]-3-oxo-isoindolin-1-ylidene]acetate CAS Name: (2Z)-2-cyano-2-[2-[(4-iodophenyl)methyl]-3-oxo-1-isoindolylidene]acetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-cyano-2-[2-[(4-iodophenyl)methyl]-3-oxoisoindol-1-ylidene]acetate Traditional Name: (2Z)-2-cyano-2-[2-(4-iodobenzyl)-3-keto-isoindolin-1-ylidene]acetic acid ethyl ester Formula: C20H15IN2O3 MolecularWeight: 458.24917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)I)C#N

Isomeric SMILES

CCOC(=O)/C(=C\1/C2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)I)/C#N

InChI

InChI=1S/C20H15IN2O3/c1-2-26-20(25)17(11-22)18-15-5-3-4-6-16(15)19(24)23(18)12-13-7-9-14(21)10-8-13/h3-10H,2,12H2,1H3/b18-17-