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

Systemtic Name: butyl 4-[2-(5-bromanylindol-1-yl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(5-bromo-1-indolyl)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(5-bromoindol-1-yl)acetyl]amino]benzoic acid butyl ester Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O3/c1-2-3-12-27-21(26)15-4-7-18(8-5-15)23-20(25)14-24-11-10-16-13-17(22)6-9-19(16)24/h4-11,13H,2-3,12,14H2,1H3,(H,23,25)