methyl 2-(2-pyridin-4-ylquinolin-4-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(2-pyridin-4-ylquinolin-4-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-[2-(4-pyridyl)quinoline-4-carbonyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-pyridin-4-ylquinoline-4-carbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-[2-(4-pyridyl)quinoline-4-carbonyl]-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C28H22N4O3 MolecularWeight: 462.49928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=NC=C6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=NC=C6

InChI

InChI=1S/C28H22N4O3/c1-35-28(34)18-6-7-24-20(14-18)22-16-32(13-10-25(22)30-24)27(33)21-15-26(17-8-11-29-12-9-17)31-23-5-3-2-4-19(21)23/h2-9,11-12,14-15,30H,10,13,16H2,1H3