2-[4-[5-methyl-1-[1-(4-pentylphenyl)propyl]pyrrol-2-yl]phenoxy]-3-phenyl-propanoate

Systemtic Name: 2-[4-[5-methyl-1-[1-(4-pentylphenyl)propyl]pyrrol-2-yl]phenoxy]-3-phenyl-propanoate Openeye Name: 2-[4-[5-methyl-1-[1-(4-pentylphenyl)propyl]pyrrol-2-yl]phenoxy]-3-phenyl-propanoate CAS Name: 2-[4-[5-methyl-1-[1-(4-pentylphenyl)propyl]-2-pyrrolyl]phenoxy]-3-phenylpropanoate IUPAC Name: 2-[4-[5-methyl-1-[1-(4-pentylphenyl)propyl]pyrrol-2-yl]phenoxy]-3-phenylpropanoate Traditional Name: 2-[4-[1-[1-(4-amylphenyl)propyl]-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propionate Formula: C34H38NO3- MolecularWeight: 508.67042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(CC)N2C(=CC=C2C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)[O-])C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(CC)N2C(=CC=C2C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)[O-])C

InChI

InChI=1S/C34H39NO3/c1-4-6-8-11-26-15-17-28(18-16-26)31(5-2)35-25(3)14-23-32(35)29-19-21-30(22-20-29)38-33(34(36)37)24-27-12-9-7-10-13-27/h7,9-10,12-23,31,33H,4-6,8,11,24H2,1-3H3,(H,36,37)/p-1