[(E)-5-[(4-chloranyl-2-iodanyl-phenyl)amino]-2-methyl-5-phenyl-pent-2-enyl] ethanoate

Systemtic Name: [(E)-5-[(4-chloranyl-2-iodanyl-phenyl)amino]-2-methyl-5-phenyl-pent-2-enyl] ethanoate Openeye Name: [(E)-5-(4-chloro-2-iodo-anilino)-2-methyl-5-phenyl-pent-2-enyl] acetate CAS Name: acetic acid [(E)-5-(4-chloro-2-iodoanilino)-2-methyl-5-phenylpent-2-enyl] ester IUPAC Name: [(E)-5-(4-chloro-2-iodoanilino)-2-methyl-5-phenylpent-2-enyl] acetate Traditional Name: acetic acid [(E)-5-(4-chloro-2-iodo-anilino)-2-methyl-5-phenyl-pent-2-enyl] ester Formula: C20H21ClINO2 MolecularWeight: 469.74371

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)Cl)I)COC(=O)C

Isomeric SMILES

C/C(=C\CC(C1=CC=CC=C1)NC2=C(C=C(C=C2)Cl)I)/COC(=O)C

InChI

InChI=1S/C20H21ClINO2/c1-14(13-25-15(2)24)8-10-19(16-6-4-3-5-7-16)23-20-11-9-17(21)12-18(20)22/h3-9,11-12,19,23H,10,13H2,1-2H3/b14-8+