1-(4,4-dimethyl-3-methylidene-pentoxy)-2-nitro-benzene

Systemtic Name: 1-(4,4-dimethyl-3-methylidene-pentoxy)-2-nitro-benzene Openeye Name: 1-(4,4-dimethyl-3-methylene-pentoxy)-2-nitro-benzene CAS Name: 1-(4,4-dimethyl-3-methylenepentoxy)-2-nitrobenzene IUPAC Name: 1-(4,4-dimethyl-3-methylidenepentoxy)-2-nitrobenzene Traditional Name: 1-(3-tert-butylbut-3-enoxy)-2-nitro-benzene Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)CCOC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=C)CCOC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C14H19NO3/c1-11(14(2,3)4)9-10-18-13-8-6-5-7-12(13)15(16)17/h5-8H,1,9-10H2,2-4H3