ethyl 5-[(4-bromophenyl)methoxy]-1-(4-ethoxyphenyl)-2-methyl-indole-3-carboxylate

Systemtic Name: ethyl 5-[(4-bromophenyl)methoxy]-1-(4-ethoxyphenyl)-2-methyl-indole-3-carboxylate Openeye Name: ethyl 5-[(4-bromophenyl)methoxy]-1-(4-ethoxyphenyl)-2-methyl-indole-3-carboxylate CAS Name: 5-[(4-bromophenyl)methoxy]-1-(4-ethoxyphenyl)-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromophenyl)methoxy]-1-(4-ethoxyphenyl)-2-methylindole-3-carboxylate Traditional Name: 5-(4-bromobenzyl)oxy-2-methyl-1-p-phenetyl-indole-3-carboxylic acid ethyl ester Formula: C27H26BrNO4 MolecularWeight: 508.40364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC4=CC=C(C=C4)Br)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC4=CC=C(C=C4)Br)C(=O)OCC)C

InChI

InChI=1S/C27H26BrNO4/c1-4-31-22-12-10-21(11-13-22)29-18(3)26(27(30)32-5-2)24-16-23(14-15-25(24)29)33-17-19-6-8-20(28)9-7-19/h6-16H,4-5,17H2,1-3H3