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

Systemtic Name: methyl (2S)-3-(4-nitrophenyl)-2-(phenacylamino)propanoate Openeye Name: methyl (2S)-3-(4-nitrophenyl)-2-(phenacylamino)propanoate CAS Name: (2S)-3-(4-nitrophenyl)-2-(phenacylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-nitrophenyl)-2-(phenacylamino)propanoate Traditional Name: (2S)-3-(4-nitrophenyl)-2-(phenacylamino)propionic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NCC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])NCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18N2O5/c1-25-18(22)16(11-13-7-9-15(10-8-13)20(23)24)19-12-17(21)14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3/t16-/m0/s1