methyl 2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-(3-bromo-4-ethoxy-5-methoxy-benzoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-bromo-4-ethoxy-5-methoxybenzoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(3-bromo-4-ethoxy-5-methoxy-benzoyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C23H23BrN2O5 MolecularWeight: 487.34312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)C(=O)OC)OC

InChI

InChI=1S/C23H23BrN2O5/c1-4-31-21-17(24)10-14(11-20(21)29-2)22(27)26-8-7-19-16(12-26)15-9-13(23(28)30-3)5-6-18(15)25-19/h5-6,9-11,25H,4,7-8,12H2,1-3H3