1-(2-chloranyl-4,4-dimethyl-pentan-2-yl)-4-nitro-benzene

Systemtic Name: 1-(2-chloranyl-4,4-dimethyl-pentan-2-yl)-4-nitro-benzene Openeye Name: 1-(1-chloro-1,3,3-trimethyl-butyl)-4-nitro-benzene CAS Name: 1-(2-chloro-4,4-dimethylpentan-2-yl)-4-nitrobenzene IUPAC Name: 1-(2-chloro-4,4-dimethylpentan-2-yl)-4-nitrobenzene Traditional Name: 1-(1-chloro-1,3,3-trimethyl-butyl)-4-nitro-benzene Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClNO2/c1-12(2,3)9-13(4,14)10-5-7-11(8-6-10)15(16)17/h5-8H,9H2,1-4H3