methyl 3-[2-(2-methylpropylamino)ethyl]-1-benzofuran-5-carboxylate

Systemtic Name: methyl 3-[2-(2-methylpropylamino)ethyl]-1-benzofuran-5-carboxylate Openeye Name: methyl 3-[2-(isobutylamino)ethyl]benzofuran-5-carboxylate CAS Name: 3-[2-(2-methylpropylamino)ethyl]-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2-methylpropylamino)ethyl]-1-benzofuran-5-carboxylate Traditional Name: 3-[2-(isobutylamino)ethyl]benzofuran-5-carboxylic acid methyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCCC1=COC2=C1C=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)CNCCC1=COC2=C1C=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H21NO3/c1-11(2)9-17-7-6-13-10-20-15-5-4-12(8-14(13)15)16(18)19-3/h4-5,8,10-11,17H,6-7,9H2,1-3H3