methyl 3-[1-(4-iodophenyl)ethylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[1-(4-iodophenyl)ethylamino]-4-methyl-benzoate Openeye Name: methyl 3-[1-(4-iodophenyl)ethylamino]-4-methyl-benzoate CAS Name: 3-[1-(4-iodophenyl)ethylamino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[1-(4-iodophenyl)ethylamino]-4-methylbenzoate Traditional Name: 3-[1-(4-iodophenyl)ethylamino]-4-methyl-benzoic acid methyl ester Formula: C17H18INO2 MolecularWeight: 395.23479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(C)C2=CC=C(C=C2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(C)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H18INO2/c1-11-4-5-14(17(20)21-3)10-16(11)19-12(2)13-6-8-15(18)9-7-13/h4-10,12,19H,1-3H3