ethyl 6-bromanyl-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylate Openeye Name: ethyl 6-bromo-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylate CAS Name: 6-bromo-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylate Traditional Name: 6-bromo-5-[(6-methoxy-3,4-dihydroisoquinolin-1-yl)methyl]-2-methyl-1H-indole-3-carboxylic acid ethyl ester Formula: C23H23BrN2O3 MolecularWeight: 455.34432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC(=C(C=C21)CC3=NCCC4=C3C=CC(=C4)OC)Br)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC(=C(C=C21)CC3=NCCC4=C3C=CC(=C4)OC)Br)C

InChI

InChI=1S/C23H23BrN2O3/c1-4-29-23(27)22-13(2)26-21-12-19(24)15(10-18(21)22)11-20-17-6-5-16(28-3)9-14(17)7-8-25-20/h5-6,9-10,12,26H,4,7-8,11H2,1-3H3