ethyl 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-5-(2-hydroxyethyl)indole-2-carboxylate

Systemtic Name: ethyl 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-5-(2-hydroxyethyl)indole-2-carboxylate Openeye Name: ethyl 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-5-(2-hydroxyethyl)indole-2-carboxylate CAS Name: 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-5-(2-hydroxyethyl)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-5-(2-hydroxyethyl)indole-2-carboxylate Traditional Name: 1-(4-fluorobenzyl)-5-(2-hydroxyethyl)-3-p-phenetyl-indole-2-carboxylic acid ethyl ester Formula: C28H28FNO4 MolecularWeight: 461.524623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)CCO)CC4=CC=C(C=C4)F)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)CCO)CC4=CC=C(C=C4)F)C(=O)OCC

InChI

InChI=1S/C28H28FNO4/c1-3-33-23-12-8-21(9-13-23)26-24-17-19(15-16-31)7-14-25(24)30(27(26)28(32)34-4-2)18-20-5-10-22(29)11-6-20/h5-14,17,31H,3-4,15-16,18H2,1-2H3