ethyl 5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-5-[2-(4-bromophenyl)-2-oxo-ethoxy]-2-methyl-indole-3-carboxylate CAS Name: 5-[2-(4-bromophenyl)-2-oxoethoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[2-(4-bromophenyl)-2-oxoethoxy]-2-methylindole-3-carboxylate Traditional Name: 1-benzyl-5-[2-(4-bromophenyl)-2-keto-ethoxy]-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C27H24BrNO4 MolecularWeight: 506.38776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)C3=CC=C(C=C3)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)C3=CC=C(C=C3)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H24BrNO4/c1-3-32-27(31)26-18(2)29(16-19-7-5-4-6-8-19)24-14-13-22(15-23(24)26)33-17-25(30)20-9-11-21(28)12-10-20/h4-15H,3,16-17H2,1-2H3