1-butan-2-yl-2-(methoxymethyl)-4-nitro-benzene

Systemtic Name: 1-butan-2-yl-2-(methoxymethyl)-4-nitro-benzene Openeye Name: 2-(methoxymethyl)-4-nitro-1-sec-butyl-benzene CAS Name: 1-butan-2-yl-2-(methoxymethyl)-4-nitrobenzene IUPAC Name: 1-butan-2-yl-2-(methoxymethyl)-4-nitrobenzene Traditional Name: 2-(methoxymethyl)-4-nitro-1-sec-butyl-benzene Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=C(C=C1)[N+](=O)[O-])COC

Isomeric SMILES

CCC(C)C1=C(C=C(C=C1)[N+](=O)[O-])COC

InChI

InChI=1S/C12H17NO3/c1-4-9(2)12-6-5-11(13(14)15)7-10(12)8-16-3/h5-7,9H,4,8H2,1-3H3