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

Systemtic Name: 2-[4-[1-(4-chlorophenyl)-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoate Openeye Name: 2-[4-[1-(4-chlorophenyl)-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoate CAS Name: 2-[4-[1-(4-chlorophenyl)-5-methyl-2-pyrrolyl]phenoxy]-3-phenylpropanoate IUPAC Name: 2-[4-[1-(4-chlorophenyl)-5-methylpyrrol-2-yl]phenoxy]-3-phenylpropanoate Traditional Name: 2-[4-[1-(4-chlorophenyl)-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propionate Formula: C26H21ClNO3- MolecularWeight: 430.90284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C26H22ClNO3/c1-18-7-16-24(28(18)22-12-10-21(27)11-13-22)20-8-14-23(15-9-20)31-25(26(29)30)17-19-5-3-2-4-6-19/h2-16,25H,17H2,1H3,(H,29,30)/p-1