3-nitro-4-(pentanoylamino)benzoic acid

Systemtic Name: 3-nitro-4-(pentanoylamino)benzoic acid Openeye Name: 3-nitro-4-(pentanoylamino)benzoic acid CAS Name: 3-nitro-4-(1-oxopentylamino)benzoic acid IUPAC Name: 3-nitro-4-(pentanoylamino)benzoic acid Traditional Name: 3-nitro-4-(valerylamino)benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O5/c1-2-3-4-11(15)13-9-6-5-8(12(16)17)7-10(9)14(18)19/h5-7H,2-4H2,1H3,(H,13,15)(H,16,17)