4-(5-methoxy-2-nitro-phenoxy)-4-(2-methylphenyl)butanoic acid

Systemtic Name: 4-(5-methoxy-2-nitro-phenoxy)-4-(2-methylphenyl)butanoic acid Openeye Name: 4-(5-methoxy-2-nitro-phenoxy)-4-(o-tolyl)butanoic acid CAS Name: 4-(5-methoxy-2-nitrophenoxy)-4-(2-methylphenyl)butanoic acid IUPAC Name: 4-(5-methoxy-2-nitrophenoxy)-4-(2-methylphenyl)butanoic acid Traditional Name: 4-(5-methoxy-2-nitro-phenoxy)-4-(o-tolyl)butyric acid Formula: C18H19NO6 MolecularWeight: 345.34656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(CCC(=O)O)OC2=C(C=CC(=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO6/c1-12-5-3-4-6-14(12)16(9-10-18(20)21)25-17-11-13(24-2)7-8-15(17)19(22)23/h3-8,11,16H,9-10H2,1-2H3,(H,20,21)