ethyl 4-[2-(5-bromanylindol-1-yl)ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(5-bromanylindol-1-yl)ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(5-bromo-1-indolyl)-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-bromoindol-1-yl)acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(5-bromoindol-1-yl)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H22BrN3O3 MolecularWeight: 408.28958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CN2C=CC3=C2C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CN2C=CC3=C2C=CC(=C3)Br

InChI

InChI=1S/C18H22BrN3O3/c1-2-25-18(24)21-9-6-15(7-10-21)20-17(23)12-22-8-5-13-11-14(19)3-4-16(13)22/h3-5,8,11,15H,2,6-7,9-10,12H2,1H3,(H,20,23)