ethyl 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate

Systemtic Name: ethyl 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Openeye Name: ethyl 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate CAS Name: 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Traditional Name: 3-(4-tert-butylphenyl)-5-(2-hydroxyethyl)-1-m-anisyl-indole-2-carboxylic acid ethyl ester Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1CC3=CC(=CC=C3)OC)C=CC(=C2)CCO)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1CC3=CC(=CC=C3)OC)C=CC(=C2)CCO)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C31H35NO4/c1-6-36-30(34)29-28(23-11-13-24(14-12-23)31(2,3)4)26-19-21(16-17-33)10-15-27(26)32(29)20-22-8-7-9-25(18-22)35-5/h7-15,18-19,33H,6,16-17,20H2,1-5H3