[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-methoxy-4-propoxy-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-methoxy-4-propoxy-benzoate Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl] 3-methoxy-4-propoxy-benzoate CAS Name: 3-methoxy-4-propoxybenzoic acid [(2S)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl] 3-methoxy-4-propoxybenzoate Traditional Name: 3-methoxy-4-propoxy-benzoic acid [(1S)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)O[C@@H](C)C(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C20H23NO5/c1-4-12-25-17-11-10-15(13-18(17)24-3)20(23)26-14(2)19(22)21-16-8-6-5-7-9-16/h5-11,13-14H,4,12H2,1-3H3,(H,21,22)/t14-/m0/s1