methyl 2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-3-methyl-pentanoate

Systemtic Name: methyl 2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-3-methyl-pentanoate Openeye Name: methyl 2-(2,3-dihydrobenzofuran-5-ylmethylamino)-3-methyl-pentanoate CAS Name: 2-(2,3-dihydrobenzofuran-5-ylmethylamino)-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-3-methylpentanoate Traditional Name: 2-(coumaran-5-ylmethylamino)-3-methyl-valeric acid methyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CC2=C(C=C1)OCC2

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CC2=C(C=C1)OCC2

InChI

InChI=1S/C16H23NO3/c1-4-11(2)15(16(18)19-3)17-10-12-5-6-14-13(9-12)7-8-20-14/h5-6,9,11,15,17H,4,7-8,10H2,1-3H3