methyl 5-[(3-bromanyl-5-methoxy-phenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylate

Systemtic Name: methyl 5-[(3-bromanyl-5-methoxy-phenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylate Openeye Name: methyl 5-[(3-bromo-5-methoxy-phenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylate CAS Name: 5-[(3-bromo-5-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3-bromo-5-methoxyphenyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylate Traditional Name: 5-(3-bromo-5-methoxy-benzyl)-7,8,9,10-tetrahydro-6H-cyclohept[b]indole-4-carboxylic acid methyl ester Formula: C23H24BrNO3 MolecularWeight: 442.34556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2C3=C(CCCCC3)C4=C2C(=CC=C4)C(=O)OC)Br

Isomeric SMILES

COC1=CC(=CC(=C1)CN2C3=C(CCCCC3)C4=C2C(=CC=C4)C(=O)OC)Br

InChI

InChI=1S/C23H24BrNO3/c1-27-17-12-15(11-16(24)13-17)14-25-21-10-5-3-4-7-18(21)19-8-6-9-20(22(19)25)23(26)28-2/h6,8-9,11-13H,3-5,7,10,14H2,1-2H3