methyl 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[1-(2,3-dihydrobenzofuran-5-yl)ethylamino]-3-methyl-pentanoate CAS Name: 2-[1-(2,3-dihydrobenzofuran-5-yl)ethylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]-3-methylpentanoate Traditional Name: 2-(1-coumaran-5-ylethylamino)-3-methyl-valeric acid methyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-5-11(2)16(17(19)20-4)18-12(3)13-6-7-15-14(10-13)8-9-21-15/h6-7,10-12,16,18H,5,8-9H2,1-4H3