methyl 2-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]-5-iodanyl-benzoate

Systemtic Name: methyl 2-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]-5-iodanyl-benzoate Openeye Name: methyl 2-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]-5-iodo-benzoate CAS Name: 2-[[(E)-3-(3,4-dichlorophenyl)-1-oxobut-2-enyl]amino]-5-iodobenzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]-5-iodobenzoate Traditional Name: 2-[[(E)-3-(3,4-dichlorophenyl)but-2-enoyl]amino]-5-iodo-benzoic acid methyl ester Formula: C18H14Cl2INO3 MolecularWeight: 490.11913

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=C(C=C1)I)C(=O)OC)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C/C(=C\C(=O)NC1=C(C=C(C=C1)I)C(=O)OC)/C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H14Cl2INO3/c1-10(11-3-5-14(19)15(20)8-11)7-17(23)22-16-6-4-12(21)9-13(16)18(24)25-2/h3-9H,1-2H3,(H,22,23)/b10-7+