1-nitro-4-octadeca-10,12-diynoxy-benzene

Systemtic Name: 1-nitro-4-octadeca-10,12-diynoxy-benzene Openeye Name: 1-nitro-4-octadeca-10,12-diynoxy-benzene CAS Name: 1-nitro-4-octadeca-10,12-diynoxybenzene IUPAC Name: 1-nitro-4-octadeca-10,12-diynoxybenzene Traditional Name: 1-nitro-4-octadeca-10,12-diynoxy-benzene Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC#CCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCC#CC#CCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C24H33NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28-24-20-18-23(19-21-24)25(26)27/h18-21H,2-5,10-17,22H2,1H3