[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (2R)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (2R)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] (2R)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2R)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2R)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2R)-2-[(2-phenoxyacetyl)amino]propionic acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O7/c1-13(21-18(23)10-26-15-5-3-2-4-6-15)20(25)27-11-19(24)22-14-7-8-16-17(9-14)29-12-28-16/h2-9,13H,10-12H2,1H3,(H,21,23)(H,22,24)/t13-/m1/s1