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

Systemtic Name: ethyl 3-(4-tert-butylphenyl)-5-ethenyl-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Openeye Name: ethyl 3-(4-tert-butylphenyl)-1-[(3-methoxyphenyl)methyl]-5-vinyl-indole-2-carboxylate CAS Name: 3-(4-tert-butylphenyl)-5-ethenyl-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-tert-butylphenyl)-5-ethenyl-1-[(3-methoxyphenyl)methyl]indole-2-carboxylate Traditional Name: 3-(4-tert-butylphenyl)-1-m-anisyl-5-vinyl-indole-2-carboxylic acid ethyl ester Formula: C31H33NO3 MolecularWeight: 467.59862

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H33NO3/c1-7-21-12-17-27-26(19-21)28(23-13-15-24(16-14-23)31(3,4)5)29(30(33)35-8-2)32(27)20-22-10-9-11-25(18-22)34-6/h7,9-19H,1,8,20H2,2-6H3