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

Systemtic Name: 2-[4-[1-[[4-(4-ethylphenyl)phenyl]methyl]-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoate Openeye Name: 2-[4-[1-[[4-(4-ethylphenyl)phenyl]methyl]-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoate CAS Name: 2-[4-[1-[[4-(4-ethylphenyl)phenyl]methyl]-5-methyl-2-pyrrolyl]phenoxy]-3-phenylpropanoate IUPAC Name: 2-[4-[1-[[4-(4-ethylphenyl)phenyl]methyl]-5-methylpyrrol-2-yl]phenoxy]-3-phenylpropanoate Traditional Name: 2-[4-[1-[4-(4-ethylphenyl)benzyl]-5-methyl-pyrrol-2-yl]phenoxy]-3-phenyl-propionate Formula: C35H32NO3- MolecularWeight: 514.63348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=C(C=C2)CN3C(=CC=C3C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=C(C=C2)CN3C(=CC=C3C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)[O-])C

InChI

InChI=1S/C35H33NO3/c1-3-26-10-14-29(15-11-26)30-16-12-28(13-17-30)24-36-25(2)9-22-33(36)31-18-20-32(21-19-31)39-34(35(37)38)23-27-7-5-4-6-8-27/h4-22,34H,3,23-24H2,1-2H3,(H,37,38)/p-1