1-chloranyl-2-(4-methylpentoxymethyl)-4-nitro-benzene

Systemtic Name: 1-chloranyl-2-(4-methylpentoxymethyl)-4-nitro-benzene Openeye Name: 1-chloro-2-(isohexyloxymethyl)-4-nitro-benzene CAS Name: 1-chloro-2-(4-methylpentoxymethyl)-4-nitrobenzene IUPAC Name: 1-chloro-2-(4-methylpentoxymethyl)-4-nitrobenzene Traditional Name: 1-chloro-2-(isohexyloxymethyl)-4-nitro-benzene Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CCCOCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H18ClNO3/c1-10(2)4-3-7-18-9-11-8-12(15(16)17)5-6-13(11)14/h5-6,8,10H,3-4,7,9H2,1-2H3