methyl 1-(5-bromanylthiophen-2-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate

Systemtic Name: methyl 1-(5-bromanylthiophen-2-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate Openeye Name: methyl 1-(5-bromo-2-thienyl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate CAS Name: 1-(5-bromo-2-thiophenyl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid methyl ester IUPAC Name: methyl 1-(5-bromothiophen-2-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate Traditional Name: 1-(5-bromo-2-thienyl)-2,3,4,9-tetrahydro-$b-carboline-1-carboxylic acid methyl ester Formula: C17H15BrN2O2S MolecularWeight: 391.2822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C2=C(CCN1)C3=CC=CC=C3N2)C4=CC=C(S4)Br

Isomeric SMILES

COC(=O)C1(C2=C(CCN1)C3=CC=CC=C3N2)C4=CC=C(S4)Br

InChI

InChI=1S/C17H15BrN2O2S/c1-22-16(21)17(13-6-7-14(18)23-13)15-11(8-9-19-17)10-4-2-3-5-12(10)20-15/h2-7,19-20H,8-9H2,1H3