2-nitro-4-(4-octan-2-yloxyphenyl)phenol

Systemtic Name: 2-nitro-4-(4-octan-2-yloxyphenyl)phenol Openeye Name: 4-[4-(1-methylheptoxy)phenyl]-2-nitro-phenol CAS Name: 2-nitro-4-(4-octan-2-yloxyphenyl)phenol IUPAC Name: 2-nitro-4-(4-octan-2-yloxyphenyl)phenol Traditional Name: 4-[4-(1-methylheptoxy)phenyl]-2-nitro-phenol Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO4/c1-3-4-5-6-7-15(2)25-18-11-8-16(9-12-18)17-10-13-20(22)19(14-17)21(23)24/h8-15,22H,3-7H2,1-2H3