methyl (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate

Systemtic Name: methyl (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Openeye Name: methyl (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-4,5-dihydrooxazole-4-carboxylate CAS Name: (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-4,5-dihydrooxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-4,5-dihydro-1,3-oxazole-4-carboxylate Traditional Name: (4S,5S)-2-(4-methoxyphenyl)-5-(2-nitrophenyl)-2-oxazoline-4-carboxylic acid methyl ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(C(O2)C3=CC=CC=C3[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=N[C@@H]([C@@H](O2)C3=CC=CC=C3[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H16N2O6/c1-24-12-9-7-11(8-10-12)17-19-15(18(21)25-2)16(26-17)13-5-3-4-6-14(13)20(22)23/h3-10,15-16H,1-2H3/t15-,16-/m0/s1