4-(3-nitro-4-propan-2-yloxy-phenyl)benzoic acid

Systemtic Name: 4-(3-nitro-4-propan-2-yloxy-phenyl)benzoic acid Openeye Name: 4-(4-isopropoxy-3-nitro-phenyl)benzoic acid CAS Name: 4-(3-nitro-4-propan-2-yloxyphenyl)benzoic acid IUPAC Name: 4-(3-nitro-4-propan-2-yloxyphenyl)benzoic acid Traditional Name: 4-(4-isopropoxy-3-nitro-phenyl)benzoic acid Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO5/c1-10(2)22-15-8-7-13(9-14(15)17(20)21)11-3-5-12(6-4-11)16(18)19/h3-10H,1-2H3,(H,18,19)