methyl 4-[2-(5-bromanylindol-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(5-bromanylindol-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(5-bromo-1-indolyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C18H15BrN2O3 MolecularWeight: 387.2273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C2C=CC(=C3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C=CC3=C2C=CC(=C3)Br

InChI

InChI=1S/C18H15BrN2O3/c1-24-18(23)12-2-5-15(6-3-12)20-17(22)11-21-9-8-13-10-14(19)4-7-16(13)21/h2-10H,11H2,1H3,(H,20,22)