methyl (2S)-2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl (2S)-2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoate Openeye Name: methyl (2S)-2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoate CAS Name: (2S)-2-[(2,2-dimethyl-1-oxopropyl)amino]-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(2,2-dimethylpropanoylamino)-3-(4-nitrophenyl)propanoate Traditional Name: (2S)-3-(4-nitrophenyl)-2-(pivaloylamino)propionic acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-15(2,3)14(19)16-12(13(18)22-4)9-10-5-7-11(8-6-10)17(20)21/h5-8,12H,9H2,1-4H3,(H,16,19)/t12-/m0/s1