ethyl 6-bromanyl-1-butyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-butyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-butyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-1-butyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-butyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methylindole-3-carboxylate Traditional Name: 6-bromo-1-butyl-5-(4-carbomethoxybenzyl)oxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C25H28BrNO5 MolecularWeight: 502.39752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=CC(=C(C=C21)Br)OCC3=CC=C(C=C3)C(=O)OC)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=CC(=C(C=C21)Br)OCC3=CC=C(C=C3)C(=O)OC)C(=O)OCC)C

InChI

InChI=1S/C25H28BrNO5/c1-5-7-12-27-16(3)23(25(29)31-6-2)19-13-22(20(26)14-21(19)27)32-15-17-8-10-18(11-9-17)24(28)30-4/h8-11,13-14H,5-7,12,15H2,1-4H3