4-(2-methoxy-5-nitro-4-propan-2-yl-phenoxy)butanoic acid

Systemtic Name: 4-(2-methoxy-5-nitro-4-propan-2-yl-phenoxy)butanoic acid Openeye Name: 4-(4-isopropyl-2-methoxy-5-nitro-phenoxy)butanoic acid CAS Name: 4-(2-methoxy-5-nitro-4-propan-2-ylphenoxy)butanoic acid IUPAC Name: 4-(2-methoxy-5-nitro-4-propan-2-ylphenoxy)butanoic acid Traditional Name: 4-(4-isopropyl-2-methoxy-5-nitro-phenoxy)butyric acid Formula: C14H19NO6 MolecularWeight: 297.30376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)O)OC

Isomeric SMILES

CC(C)C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)O)OC

InChI

InChI=1S/C14H19NO6/c1-9(2)10-7-12(20-3)13(8-11(10)15(18)19)21-6-4-5-14(16)17/h7-9H,4-6H2,1-3H3,(H,16,17)