[(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [(2R)-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [(1R)-1-methyl-2-morpholino-2-oxo-ethyl] (2S)-2-[(4-chloro-3-nitro-benzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-3-methylbutanoic acid [(2R)-1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-morpholin-4-yl-1-oxopropan-2-yl] (2S)-2-[(4-chloro-3-nitrobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-chloro-3-nitro-benzoyl)amino]-3-methyl-butyric acid [(1R)-2-keto-1-methyl-2-morpholino-ethyl] ester Formula: C19H24ClN3O7 MolecularWeight: 441.86276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)N1CCOCC1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N1CCOCC1)OC(=O)[C@H](C(C)C)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H24ClN3O7/c1-11(2)16(19(26)30-12(3)18(25)22-6-8-29-9-7-22)21-17(24)13-4-5-14(20)15(10-13)23(27)28/h4-5,10-12,16H,6-9H2,1-3H3,(H,21,24)/t12-,16+/m1/s1