3-methyl-3-[(4-nitrophenyl)carbonylamino]butanoate

Systemtic Name: 3-methyl-3-[(4-nitrophenyl)carbonylamino]butanoate Openeye Name: 3-methyl-3-[(4-nitrobenzoyl)amino]butanoate CAS Name: 3-methyl-3-[[(4-nitrophenyl)-oxomethyl]amino]butanoate IUPAC Name: 3-methyl-3-[(4-nitrobenzoyl)amino]butanoate Traditional Name: 3-methyl-3-[(4-nitrobenzoyl)amino]butyrate Formula: C12H13N2O5- MolecularWeight: 265.24202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5/c1-12(2,7-10(15)16)13-11(17)8-3-5-9(6-4-8)14(18)19/h3-6H,7H2,1-2H3,(H,13,17)(H,15,16)/p-1