4-(2-methyl-3-nitro-phenoxy)butan-1-ol

Systemtic Name: 4-(2-methyl-3-nitro-phenoxy)butan-1-ol Openeye Name: 4-(2-methyl-3-nitro-phenoxy)butan-1-ol CAS Name: 4-(2-methyl-3-nitrophenoxy)-1-butanol IUPAC Name: 4-(2-methyl-3-nitrophenoxy)butan-1-ol Traditional Name: 4-(2-methyl-3-nitro-phenoxy)butan-1-ol Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OCCCCO)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1OCCCCO)[N+](=O)[O-]

InChI

InChI=1S/C11H15NO4/c1-9-10(12(14)15)5-4-6-11(9)16-8-3-2-7-13/h4-6,13H,2-3,7-8H2,1H3