[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] (2S)-2-phenoxybutanoate CAS Name: (2S)-2-phenoxybutanoic acid [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] (2S)-2-phenoxybutanoate Traditional Name: (2S)-2-phenoxybutyric acid [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)OC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)OCC(=O)NC1=CC2=C(C=C1)OCO2)OC3=CC=CC=C3

InChI

InChI=1S/C19H19NO6/c1-2-15(26-14-6-4-3-5-7-14)19(22)23-11-18(21)20-13-8-9-16-17(10-13)25-12-24-16/h3-10,15H,2,11-12H2,1H3,(H,20,21)/t15-/m0/s1