[(2R)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-(4-acetyloxyphenyl)benzoate

Systemtic Name: [(2R)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-(4-acetyloxyphenyl)benzoate Openeye Name: [(1R)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl] 3-(4-acetoxyphenyl)benzoate CAS Name: 3-(4-acetyloxyphenyl)benzoic acid [(2R)-1-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl] 3-(4-acetyloxyphenyl)benzoate Traditional Name: 3-(4-acetoxyphenyl)benzoic acid [(1R)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H21NO6 MolecularWeight: 407.41594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CO1)OC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C23H21NO6/c1-15(22(26)24-14-21-7-4-12-28-21)29-23(27)19-6-3-5-18(13-19)17-8-10-20(11-9-17)30-16(2)25/h3-13,15H,14H2,1-2H3,(H,24,26)/t15-/m1/s1