2-(chloromethyl)-4-nitro-1-pentoxy-benzene

Systemtic Name: 2-(chloromethyl)-4-nitro-1-pentoxy-benzene Openeye Name: 2-(chloromethyl)-4-nitro-1-pentoxy-benzene CAS Name: 2-(chloromethyl)-4-nitro-1-pentoxybenzene IUPAC Name: 2-(chloromethyl)-4-nitro-1-pentoxybenzene Traditional Name: 1-amoxy-2-(chloromethyl)-4-nitro-benzene Formula: C12H16ClNO3 MolecularWeight: 257.71334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])CCl

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])CCl

InChI

InChI=1S/C12H16ClNO3/c1-2-3-4-7-17-12-6-5-11(14(15)16)8-10(12)9-13/h5-6,8H,2-4,7,9H2,1H3