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

Systemtic Name: 4-[[2-(5-bromanylindol-1-yl)ethanoylamino]methyl]benzoate Openeye Name: 4-[[[2-(5-bromoindol-1-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(5-bromo-1-indolyl)-1-oxoethyl]amino]methyl]benzoate IUPAC Name: 4-[[[2-(5-bromoindol-1-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(5-bromoindol-1-yl)acetyl]amino]methyl]benzoate Formula: C18H14BrN2O3- MolecularWeight: 386.21936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CN2C=CC3=C2C=CC(=C3)Br)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CN2C=CC3=C2C=CC(=C3)Br)C(=O)[O-]

InChI

InChI=1S/C18H15BrN2O3/c19-15-5-6-16-14(9-15)7-8-21(16)11-17(22)20-10-12-1-3-13(4-2-12)18(23)24/h1-9H,10-11H2,(H,20,22)(H,23,24)/p-1