ethyl 3-(2-bromanylhexanoylamino)-5-methoxy-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-(2-bromanylhexanoylamino)-5-methoxy-1H-indole-2-carboxylate Openeye Name: ethyl 3-(2-bromohexanoylamino)-5-methoxy-1H-indole-2-carboxylate CAS Name: 3-[(2-bromo-1-oxohexyl)amino]-5-methoxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-bromohexanoylamino)-5-methoxy-1H-indole-2-carboxylate Traditional Name: 3-(2-bromohexanoylamino)-5-methoxy-1H-indole-2-carboxylic acid ethyl ester Formula: C18H23BrN2O4 MolecularWeight: 411.29022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=C(NC2=C1C=C(C=C2)OC)C(=O)OCC)Br

Isomeric SMILES

CCCCC(C(=O)NC1=C(NC2=C1C=C(C=C2)OC)C(=O)OCC)Br

InChI

InChI=1S/C18H23BrN2O4/c1-4-6-7-13(19)17(22)21-15-12-10-11(24-3)8-9-14(12)20-16(15)18(23)25-5-2/h8-10,13,20H,4-7H2,1-3H3,(H,21,22)