2-chloranyl-5-nitro-benzoic acid; 2-ethyl-6-methyl-pyridin-3-ol

Systemtic Name: 2-chloranyl-5-nitro-benzoic acid; 2-ethyl-6-methyl-pyridin-3-ol Openeye Name: 2-chloro-5-nitro-benzoic acid; 2-ethyl-6-methyl-pyridin-3-ol CAS Name: 2-chloro-5-nitrobenzoic acid; 2-ethyl-6-methyl-3-pyridinol IUPAC Name: 2-chloro-5-nitrobenzoic acid; 2-ethyl-6-methylpyridin-3-ol Traditional Name: 2-chloro-5-nitro-benzoic acid; 2-ethyl-6-methyl-pyridin-3-ol Formula: C15H15ClN2O5 MolecularWeight: 338.743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=N1)C)O.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl

Isomeric SMILES

CCC1=C(C=CC(=N1)C)O.C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl

InChI

InChI=1S/C8H11NO.C7H4ClNO4/c1-3-7-8(10)5-4-6(2)9-7;8-6-2-1-4(9(12)13)3-5(6)7(10)11/h4-5,10H,3H2,1-2H3;1-3H,(H,10,11)