5-methyl-2-propan-2-yl-phenol; 2-nitrophenol

Systemtic Name: 5-methyl-2-propan-2-yl-phenol; 2-nitrophenol Openeye Name: 2-isopropyl-5-methyl-phenol; 2-nitrophenol CAS Name: 5-methyl-2-propan-2-ylphenol; 2-nitrophenol IUPAC Name: 5-methyl-2-propan-2-ylphenol; 2-nitrophenol Traditional Name: 2-nitrophenol; thymol Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)O.C1=CC=C(C(=C1)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)O.C1=CC=C(C(=C1)[N+](=O)[O-])O

InChI

InChI=1S/C10H14O.C6H5NO3/c1-7(2)9-5-4-8(3)6-10(9)11;8-6-4-2-1-3-5(6)7(9)10/h4-7,11H,1-3H3;1-4,8H