methyl 3-[butyl(methyl)carbamoyl]-5-iodanyl-benzoate

Systemtic Name: methyl 3-[butyl(methyl)carbamoyl]-5-iodanyl-benzoate Openeye Name: methyl 3-[butyl(methyl)carbamoyl]-5-iodo-benzoate CAS Name: 3-[[butyl(methyl)amino]-oxomethyl]-5-iodobenzoic acid methyl ester IUPAC Name: methyl 3-[butyl(methyl)carbamoyl]-5-iodobenzoate Traditional Name: 3-[butyl(methyl)carbamoyl]-5-iodo-benzoic acid methyl ester Formula: C14H18INO3 MolecularWeight: 375.20209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC(=CC(=C1)I)C(=O)OC

Isomeric SMILES

CCCCN(C)C(=O)C1=CC(=CC(=C1)I)C(=O)OC

InChI

InChI=1S/C14H18INO3/c1-4-5-6-16(2)13(17)10-7-11(14(18)19-3)9-12(15)8-10/h7-9H,4-6H2,1-3H3