ethyl 3-[(2S)-2-methylmorpholin-4-yl]carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-[(2S)-2-methylmorpholin-4-yl]carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-[(2S)-2-methylmorpholine-4-carbonyl]-5-nitro-benzoate CAS Name: 3-[[(2S)-2-methyl-4-morpholinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(2S)-2-methylmorpholine-4-carbonyl]-5-nitrobenzoate Traditional Name: 3-[(2S)-2-methylmorpholine-4-carbonyl]-5-nitro-benzoic acid ethyl ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCOC(C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCO[C@H](C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6/c1-3-22-15(19)12-6-11(7-13(8-12)17(20)21)14(18)16-4-5-23-10(2)9-16/h6-8,10H,3-5,9H2,1-2H3/t10-/m0/s1