methyl 1-(4-bromanylthiophen-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=C(C(N1)C3=CC(=CS3)Br)NC4=CC=CC=C24

Isomeric SMILES

COC(=O)C1CC2=C(C(N1)C3=CC(=CS3)Br)NC4=CC=CC=C24

InChI

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