methyl 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methyl-pentanoate

Systemtic Name: methyl 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methyl-pentanoate Openeye Name: methyl 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methyl-pentanoate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methylpentanoate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)-3-methyl-valeric acid methyl ester Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=C2C(=CC=C1)OCCO2

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=C2C(=CC=C1)OCCO2

InChI

InChI=1S/C16H23NO4/c1-4-11(2)14(16(18)19-3)17-10-12-6-5-7-13-15(12)21-9-8-20-13/h5-7,11,14,17H,4,8-10H2,1-3H3