ethyl 1-(7-bromanyl-8-phenylmethoxy-quinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 1-(7-bromanyl-8-phenylmethoxy-quinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 1-(8-benzyloxy-7-bromo-2-quinolyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(7-bromo-8-phenylmethoxy-2-quinolinyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(7-bromo-8-phenylmethoxyquinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(8-benzoxy-7-bromo-2-quinolyl)-4-methyl-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C31H24BrN3O3 MolecularWeight: 566.44456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C2C(=C1C)C3=CC=CC=C3N2)C4=NC5=C(C=CC(=C5OCC6=CC=CC=C6)Br)C=C4

Isomeric SMILES

CCOC(=O)C1=NC(=C2C(=C1C)C3=CC=CC=C3N2)C4=NC5=C(C=CC(=C5OCC6=CC=CC=C6)Br)C=C4

InChI

InChI=1S/C31H24BrN3O3/c1-3-37-31(36)26-18(2)25-21-11-7-8-12-23(21)33-29(25)28(35-26)24-16-14-20-13-15-22(32)30(27(20)34-24)38-17-19-9-5-4-6-10-19/h4-16,33H,3,17H2,1-2H3