methyl 3-nitro-2-(propanoylamino)benzoate

Systemtic Name: methyl 3-nitro-2-(propanoylamino)benzoate Openeye Name: methyl 3-nitro-2-(propanoylamino)benzoate CAS Name: 3-nitro-2-(1-oxopropylamino)benzoic acid methyl ester IUPAC Name: methyl 3-nitro-2-(propanoylamino)benzoate Traditional Name: 3-nitro-2-propionamido-benzoic acid methyl ester Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-3-9(14)12-10-7(11(15)18-2)5-4-6-8(10)13(16)17/h4-6H,3H2,1-2H3,(H,12,14)