methyl (2S)-3-(4-nitrophenyl)-2-propoxy-propanoate

Systemtic Name: methyl (2S)-3-(4-nitrophenyl)-2-propoxy-propanoate Openeye Name: methyl (2S)-3-(4-nitrophenyl)-2-propoxy-propanoate CAS Name: (2S)-3-(4-nitrophenyl)-2-propoxypropanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-nitrophenyl)-2-propoxypropanoate Traditional Name: (2S)-3-(4-nitrophenyl)-2-propoxy-propionic acid methyl ester Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCCO[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H17NO5/c1-3-8-19-12(13(15)18-2)9-10-4-6-11(7-5-10)14(16)17/h4-7,12H,3,8-9H2,1-2H3/t12-/m0/s1