methyl 3-acetamido-4-tert-butyl-2-nitro-benzoate

Systemtic Name: methyl 3-acetamido-4-tert-butyl-2-nitro-benzoate Openeye Name: methyl 3-acetamido-4-tert-butyl-2-nitro-benzoate CAS Name: 3-acetamido-4-tert-butyl-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-acetamido-4-tert-butyl-2-nitrobenzoate Traditional Name: 3-acetamido-4-tert-butyl-2-nitro-benzoic acid methyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1[N+](=O)[O-])C(=O)OC)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1[N+](=O)[O-])C(=O)OC)C(C)(C)C

InChI

InChI=1S/C14H18N2O5/c1-8(17)15-11-10(14(2,3)4)7-6-9(13(18)21-5)12(11)16(19)20/h6-7H,1-5H3,(H,15,17)