1-[4-[bis(4-methylphenyl)amino]phenyl]heptane-1,4,7-triol

Systemtic Name: 1-[4-[bis(4-methylphenyl)amino]phenyl]heptane-1,4,7-triol Openeye Name: 1-[4-[4-methyl-N-(p-tolyl)anilino]phenyl]heptane-1,4,7-triol CAS Name: 1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]heptane-1,4,7-triol IUPAC Name: 1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]heptane-1,4,7-triol Traditional Name: 1-[4-[4-methyl-N-(p-tolyl)anilino]phenyl]heptane-1,4,7-triol Formula: C27H33NO3 MolecularWeight: 419.55582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C(CCC(CCCO)O)O

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C(CCC(CCCO)O)O

InChI

InChI=1S/C27H33NO3/c1-20-5-11-23(12-6-20)28(24-13-7-21(2)8-14-24)25-15-9-22(10-16-25)27(31)18-17-26(30)4-3-19-29/h5-16,26-27,29-31H,3-4,17-19H2,1-2H3