5-tert-butyl-1-isocyanato-2-methoxy-3-nitro-benzene

Systemtic Name: 5-tert-butyl-1-isocyanato-2-methoxy-3-nitro-benzene Openeye Name: 5-tert-butyl-1-isocyanato-2-methoxy-3-nitro-benzene CAS Name: 5-tert-butyl-1-isocyanato-2-methoxy-3-nitrobenzene IUPAC Name: 5-tert-butyl-1-isocyanato-2-methoxy-3-nitrobenzene Traditional Name: 5-tert-butyl-1-isocyanato-2-methoxy-3-nitro-benzene Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4/c1-12(2,3)8-5-9(13-7-15)11(18-4)10(6-8)14(16)17/h5-6H,1-4H3