2-[4-(5-methyl-1-nonyl-pyrrol-2-yl)phenoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-[4-(5-methyl-1-nonyl-pyrrol-2-yl)phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-(5-methyl-1-nonyl-pyrrol-2-yl)phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-(5-methyl-1-nonyl-2-pyrrolyl)phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-(5-methyl-1-nonylpyrrol-2-yl)phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-(5-methyl-1-nonyl-pyrrol-2-yl)phenoxy]-3-phenyl-propionic acid Formula: C29H37NO3 MolecularWeight: 447.60898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C(=CC=C1C2=CC=C(C=C2)OC(CC3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CCCCCCCCCN1C(=CC=C1C2=CC=C(C=C2)OC(CC3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C29H37NO3/c1-3-4-5-6-7-8-12-21-30-23(2)15-20-27(30)25-16-18-26(19-17-25)33-28(29(31)32)22-24-13-10-9-11-14-24/h9-11,13-20,28H,3-8,12,21-22H2,1-2H3,(H,31,32)