2-[(4-chloranyl-2-methyl-phenoxy)methyl]-1-heptoxy-4-nitro-benzene

Systemtic Name: 2-[(4-chloranyl-2-methyl-phenoxy)methyl]-1-heptoxy-4-nitro-benzene Openeye Name: 2-[(4-chloro-2-methyl-phenoxy)methyl]-1-heptoxy-4-nitro-benzene CAS Name: 2-[(4-chloro-2-methylphenoxy)methyl]-1-heptoxy-4-nitrobenzene IUPAC Name: 2-[(4-chloro-2-methylphenoxy)methyl]-1-heptoxy-4-nitrobenzene Traditional Name: 2-[(4-chloro-2-methyl-phenoxy)methyl]-1-heptoxy-4-nitro-benzene Formula: C21H26ClNO4 MolecularWeight: 391.88844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])COC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])COC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C21H26ClNO4/c1-3-4-5-6-7-12-26-21-11-9-19(23(24)25)14-17(21)15-27-20-10-8-18(22)13-16(20)2/h8-11,13-14H,3-7,12,15H2,1-2H3