[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-benzoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-benzoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-ethoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-ethoxybenzoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxybenzoate Traditional Name: 2-ethoxy-5-(phthalimidomethyl)benzoic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC(C)C(=O)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)O[C@H](C)C(=O)N

InChI

InChI=1S/C21H20N2O6/c1-3-28-17-9-8-13(10-16(17)21(27)29-12(2)18(22)24)11-23-19(25)14-6-4-5-7-15(14)20(23)26/h4-10,12H,3,11H2,1-2H3,(H2,22,24)/t12-/m1/s1