[3-ethanoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 3-bromanylbenzoate

Systemtic Name: [3-ethanoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 3-bromanylbenzoate Openeye Name: [3-acetyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [3-acetyl-1-(4-methoxyphenyl)-2-methyl-5-indolyl] ester IUPAC Name: [3-acetyl-1-(4-methoxyphenyl)-2-methylindol-5-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [3-acetyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] ester Formula: C25H20BrNO4 MolecularWeight: 478.3346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)C4=CC(=CC=C4)Br)C(=O)C

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)C4=CC(=CC=C4)Br)C(=O)C

InChI

InChI=1S/C25H20BrNO4/c1-15-24(16(2)28)22-14-21(31-25(29)17-5-4-6-18(26)13-17)11-12-23(22)27(15)19-7-9-20(30-3)10-8-19/h4-14H,1-3H3