1-[4-[(4-heptanoyl-2-methyl-phenyl)diazenyl]-3-methyl-phenyl]heptan-1-one

Systemtic Name: 1-[4-[(4-heptanoyl-2-methyl-phenyl)diazenyl]-3-methyl-phenyl]heptan-1-one Openeye Name: 1-[4-(4-heptanoyl-2-methyl-phenyl)azo-3-methyl-phenyl]heptan-1-one CAS Name: 1-[3-methyl-4-[2-methyl-4-(1-oxoheptyl)phenyl]azophenyl]-1-heptanone IUPAC Name: 1-[4-[(4-heptanoyl-2-methylphenyl)diazenyl]-3-methylphenyl]heptan-1-one Traditional Name: 1-[4-(4-enanthyl-2-methyl-phenyl)azo-3-methyl-phenyl]heptan-1-one Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)C(=O)CCCCCC)C)C

Isomeric SMILES

CCCCCCC(=O)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)C(=O)CCCCCC)C)C

InChI

InChI=1S/C28H38N2O2/c1-5-7-9-11-13-27(31)23-15-17-25(21(3)19-23)29-30-26-18-16-24(20-22(26)4)28(32)14-12-10-8-6-2/h15-20H,5-14H2,1-4H3