[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] pentanoate

Systemtic Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] pentanoate Openeye Name: [(1R)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] pentanoate Traditional Name: valeric acid [(1R)-2-keto-1-methyl-2-(piperonylamino)ethyl] ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C)C(=O)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCC(=O)O[C@H](C)C(=O)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H21NO5/c1-3-4-5-15(18)22-11(2)16(19)17-9-12-6-7-13-14(8-12)21-10-20-13/h6-8,11H,3-5,9-10H2,1-2H3,(H,17,19)/t11-/m1/s1