2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]phenol

Systemtic Name: 2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]phenol Openeye Name: 2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]phenol CAS Name: 2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methyl-2-pyrrolyl]phenol IUPAC Name: 2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methylpyrrol-2-yl]phenol Traditional Name: 2-[1-[2-(4-heptoxyphenyl)ethyl]-5-methyl-pyrrol-2-yl]phenol Formula: C26H33NO2 MolecularWeight: 391.54572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCN2C(=CC=C2C3=CC=CC=C3O)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCN2C(=CC=C2C3=CC=CC=C3O)C

InChI

InChI=1S/C26H33NO2/c1-3-4-5-6-9-20-29-23-15-13-22(14-16-23)18-19-27-21(2)12-17-25(27)24-10-7-8-11-26(24)28/h7-8,10-17,28H,3-6,9,18-20H2,1-2H3