1-chloranyl-4-(1-nitrohexan-2-yl)benzene

Systemtic Name: 1-chloranyl-4-(1-nitrohexan-2-yl)benzene Openeye Name: 1-chloro-4-[1-(nitromethyl)pentyl]benzene CAS Name: 1-chloro-4-(1-nitrohexan-2-yl)benzene IUPAC Name: 1-chloro-4-(1-nitrohexan-2-yl)benzene Traditional Name: 1-chloro-4-[1-(nitromethyl)pentyl]benzene Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO2/c1-2-3-4-11(9-14(15)16)10-5-7-12(13)8-6-10/h5-8,11H,2-4,9H2,1H3