[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-(3-methyl-4-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-(3-methyl-4-propan-2-yl-phenoxy)ethanoate Openeye Name: [(1R)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl] 2-(4-isopropyl-3-methyl-phenoxy)acetate CAS Name: 2-(3-methyl-4-propan-2-ylphenoxy)acetic 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] 2-(3-methyl-4-propan-2-ylphenoxy)acetate Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)acetic acid [(1R)-2-keto-1-methyl-2-(piperonylamino)ethyl] ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O[C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)C(C)C

InChI

InChI=1S/C23H27NO6/c1-14(2)19-7-6-18(9-15(19)3)27-12-22(25)30-16(4)23(26)24-11-17-5-8-20-21(10-17)29-13-28-20/h5-10,14,16H,11-13H2,1-4H3,(H,24,26)/t16-/m1/s1