methyl 2-[(5-iodanylfuran-2-yl)methylamino]-5-methyl-benzoate

Systemtic Name: methyl 2-[(5-iodanylfuran-2-yl)methylamino]-5-methyl-benzoate Openeye Name: methyl 2-[(5-iodo-2-furyl)methylamino]-5-methyl-benzoate CAS Name: 2-[(5-iodo-2-furanyl)methylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[(5-iodofuran-2-yl)methylamino]-5-methylbenzoate Traditional Name: 2-[(5-iodo-2-furyl)methylamino]-5-methyl-benzoic acid methyl ester Formula: C14H14INO3 MolecularWeight: 371.17033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC2=CC=C(O2)I)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NCC2=CC=C(O2)I)C(=O)OC

InChI

InChI=1S/C14H14INO3/c1-9-3-5-12(11(7-9)14(17)18-2)16-8-10-4-6-13(15)19-10/h3-7,16H,8H2,1-2H3