2-methyl-1-nitro-4-octadecoxy-benzene

Systemtic Name: 2-methyl-1-nitro-4-octadecoxy-benzene Openeye Name: 2-methyl-1-nitro-4-octadecoxy-benzene CAS Name: 2-methyl-1-nitro-4-octadecoxybenzene IUPAC Name: 2-methyl-1-nitro-4-octadecoxybenzene Traditional Name: 2-methyl-1-nitro-4-stearyloxy-benzene Formula: C25H43NO3 MolecularWeight: 405.61382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C25H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-24-19-20-25(26(27)28)23(2)22-24/h19-20,22H,3-18,21H2,1-2H3