3-nitro-5-(3-oxidanylpropylcarbamoyl)benzoic acid

Systemtic Name: 3-nitro-5-(3-oxidanylpropylcarbamoyl)benzoic acid Openeye Name: 3-(3-hydroxypropylcarbamoyl)-5-nitro-benzoic acid CAS Name: 3-[(3-hydroxypropylamino)-oxomethyl]-5-nitrobenzoic acid IUPAC Name: 3-(3-hydroxypropylcarbamoyl)-5-nitrobenzoic acid Traditional Name: 3-(3-hydroxypropylcarbamoyl)-5-nitro-benzoic acid Formula: C11H12N2O6 MolecularWeight: 268.22278

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)NCCCO

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)NCCCO

InChI

InChI=1S/C11H12N2O6/c14-3-1-2-12-10(15)7-4-8(11(16)17)6-9(5-7)13(18)19/h4-6,14H,1-3H2,(H,12,15)(H,16,17)