methyl 2-chloranyl-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodanyl-benzoate

Systemtic Name: methyl 2-chloranyl-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodanyl-benzoate Openeye Name: methyl 2-chloro-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodo-benzoate CAS Name: 2-chloro-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodobenzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodobenzoate Traditional Name: 2-chloro-4-[4-(2-dimethylaminoethyl)phenoxy]-5-iodo-benzoic acid methyl ester Formula: C18H19ClINO3 MolecularWeight: 459.70583

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CC=C(C=C1)OC2=C(C=C(C(=C2)Cl)C(=O)OC)I

Isomeric SMILES

CN(C)CCC1=CC=C(C=C1)OC2=C(C=C(C(=C2)Cl)C(=O)OC)I

InChI

InChI=1S/C18H19ClINO3/c1-21(2)9-8-12-4-6-13(7-5-12)24-17-11-15(19)14(10-16(17)20)18(22)23-3/h4-7,10-11H,8-9H2,1-3H3