ethyl 3-nitro-4-(pentanoylamino)benzoate

Systemtic Name: ethyl 3-nitro-4-(pentanoylamino)benzoate Openeye Name: ethyl 3-nitro-4-(pentanoylamino)benzoate CAS Name: 3-nitro-4-(1-oxopentylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-4-(pentanoylamino)benzoate Traditional Name: 3-nitro-4-(valerylamino)benzoic acid ethyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-3-5-6-13(17)15-11-8-7-10(14(18)21-4-2)9-12(11)16(19)20/h7-9H,3-6H2,1-2H3,(H,15,17)